(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide

C331H380Cl7N51O58S24 — CID 159322847

About (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide

(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide (PubChem CID 159322847) has the molecular formula C331H380Cl7N51O58S24 and a molecular weight of 7018.76 g/mol. Its IUPAC name is (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide.

Molecular Properties

• Compound Name: (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide
• PubChem CID: 159322847
• Molecular Formula: C331H380Cl7N51O58S24
• Molecular Weight: 7018.76 g/mol
• Exact Mass: 7008.95
• IUPAC Name: (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide
• SMILES: CN(C)CC(=O)Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1.CNc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3Cl)cs2)cs1.Cc1cccc(C)c1Cc1csc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(CN(C)C)c2)n1.Cc1csc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)n1.Cc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)cs1.Cc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3Cl)cs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2ccc(Cc3ccccc3Cl)s2)cs1.O=C(NCc1cc(Cc2ccccc2Cl)cs1)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1cscn1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1ccccn1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1cccnc1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1ccncc1.O=C(Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1)C1CCNCC1
• InChI: InChI=1S/C30H38N4O4S.3C25H26ClN3O4S.C24H27ClN4O4S2.C24H26ClN3O4S2.2C24H27N3O4S2.C23H25ClN4O4S2.C23H24ClN3O4S2.C23H31N5O5S2.C23H26N4O4S2.C21H29N5O5S2.C17H22N4O4S2/c1-19-8-5-9-20(2)24(19)15-23-18-39-26(32-23)16-31-29(37)27(35)28(36)30(38)34-13-7-12-25(34)22-11-6-10-21(14-22)17-33(3)4;26-20-7-2-1-5-16(20)13-18-9-10-19(34-18)15-28-24(32)22(30)23(31)25(33)29-12-4-8-21(29)17-6-3-11-27-14-17;26-19-7-2-1-6-16(19)14-17-10-11-18(34-17)15-28-24(32)22(30)23(31)25(33)29-13-5-9-21(29)20-8-3-4-12-27-20;26-20-5-2-1-4-17(20)14-18-7-8-19(34-18)15-28-24(32)22(30)23(31)25(33)29-13-3-6-21(29)16-9-11-27-12-10-16;1-26-24-28-18(13-35-24)19-7-4-8-29(19)23(33)21(31)20(30)22(32)27-11-16-10-14(12-34-16)9-15-5-2-3-6-17(15)25;1-14-27-19(13-33-14)20-7-4-8-28(20)24(32)22(30)21(29)23(31)26-11-17-10-15(12-34-17)9-16-5-2-3-6-18(16)25;1-15-26-19(14-32-15)20-8-5-9-27(20)24(31)22(29)21(28)23(30)25-12-18-11-17(13-33-18)10-16-6-3-2-4-7-16;1-15-13-33-23(26-15)19-8-5-9-27(19)24(31)21(29)20(28)22(30)25-12-18-11-17(14-32-18)10-16-6-3-2-4-7-16;24-16-5-2-1-4-13(16)10-14-7-8-15(34-14)11-26-21(31)19(29)20(30)22(32)28-9-3-6-18(28)17-12-33-23(25)27-17;24-17-5-2-1-4-15(17)8-14-9-16(33-11-14)10-25-22(30)20(28)21(29)23(31)27-7-3-6-19(27)18-12-32-13-26-18;29-18(21(32)25-10-7-15-3-2-12-34-15)19(30)22(33)28-11-1-4-17(28)16-13-35-23(26-16)27-20(31)14-5-8-24-9-6-14;24-23-26-17(13-33-23)18-7-4-8-27(18)22(31)20(29)19(28)21(30)25-11-16-10-15(12-32-16)9-14-5-2-1-3-6-14;1-25(2)11-16(27)24-21-23-14(12-33-21)15-6-3-9-26(15)20(31)18(29)17(28)19(30)22-8-7-13-5-4-10-32-13;18-17-20-11(9-27-17)12-4-1-7-21(12)16(25)14(23)13(22)15(24)19-6-5-10-3-2-8-26-10/h5-6,8-11,14,18,25,27-28,35-36H,7,12-13,15-17H2,1-4H3,(H,31,37);1-3,5-7,9-11,14,21-23,30-31H,4,8,12-13,15H2,(H,28,32);1-4,6-8,10-12,21-23,30-31H,5,9,13-15H2,(H,28,32);1-2,4-5,7-12,21-23,30-31H,3,6,13-15H2,(H,28,32);2-3,5-6,10,12-13,19-21,30-31H,4,7-9,11H2,1H3,(H,26,28)(H,27,32);2-3,5-6,10,12-13,20-22,29-30H,4,7-9,11H2,1H3,(H,26,31);2-4,6-7,11,13-14,20-22,28-29H,5,8-10,12H2,1H3,(H,25,30);2-4,6-7,11,13-14,19-21,28-29H,5,8-10,12H2,1H3,(H,25,30);1-2,4-5,7-8,12,18-20,29-30H,3,6,9-11H2,(H2,25,27)(H,26,31);1-2,4-5,9,11-13,19-21,28-29H,3,6-8,10H2,(H,25,30);2-3,12-14,17-19,24,29-30H,1,4-11H2,(H,25,32)(H,26,27,31);1-3,5-6,10,12-13,18-20,28-29H,4,7-9,11H2,(H2,24,26)(H,25,30);4-5,10,12,15,17-18,28-29H,3,6-9,11H2,1-2H3,(H,22,30)(H,23,24,27);2-3,8-9,12-14,22-23H,1,4-7H2,(H2,18,20)(H,19,24)/t25?,27-,28-;3*21?,22-,23-;19-,20-,21-;2*20-,21-,22-;19-,20-,21-;18-,19-,20-;19-,20-,21-;17-,18-,19-;18-,19-,20-;15-,17-,18-;12-,13-,14-/m11111111111111/s1
• InChIKey: LDZFFANGHXYMLY-ONTQMXEUSA-N
• XLogP: 34.47
• TPSA: 1605.44 Ų
• H-Bond Donors: 49
• H-Bond Acceptors: 103
• Rotatable Bonds: 117
• Heavy Atoms: 471
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	7018.76
LogP ≤ 5	34.47
H-Bond Donors ≤ 5	49
H-Bond Acceptors ≤ 10	103

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide?

The IUPAC name of (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide (CID 159322847) is (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide.

What is the SMILES notation for (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide?

The canonical SMILES for (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide is CN(C)CC(=O)Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1.CNc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3Cl)cs2)cs1.Cc1cccc(C)c1Cc1csc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(CN(C)C)c2)n1.Cc1csc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)n1.Cc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)cs1.Cc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3Cl)cs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2cc(Cc3ccccc3)cs2)cs1.Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCc2ccc(Cc3ccccc3Cl)s2)cs1.O=C(NCc1cc(Cc2ccccc2Cl)cs1)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1cscn1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1ccccn1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1cccnc1.O=C(NCc1ccc(Cc2ccccc2Cl)s1)[C@H](O)[C@@H](O)C(=O)N1CCCC1c1ccncc1.O=C(Nc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)NCCc2cccs2)cs1)C1CCNCC1.

What is the InChIKey of (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide?

The InChIKey is LDZFFANGHXYMLY-ONTQMXEUSA-N. The full InChI is InChI=1S/C30H38N4O4S.3C25H26ClN3O4S.C24H27ClN4O4S2.C24H26ClN3O4S2.2C24H27N3O4S2.C23H25ClN4O4S2.C23H24ClN3O4S2.C23H31N5O5S2.C23H26N4O4S2.C21H29N5O5S2.C17H22N4O4S2/c1-19-8-5-9-20(2)24(19)15-23-18-39-26(32-23)16-31-29(37)27(35)28(36)30(38)34-13-7-12-25(34)22-11-6-10-21(14-22)17-33(3)4;26-20-7-2-1-5-16(20)13-18-9-10-19(34-18)15-28-24(32)22(30)23(31)25(33)29-12-4-8-21(29)17-6-3-11-27-14-17;26-19-7-2-1-6-16(19)14-17-10-11-18(34-17)15-28-24(32)22(30)23(31)25(33)29-13-5-9-21(29)20-8-3-4-12-27-20;26-20-5-2-1-4-17(20)14-18-7-8-19(34-18)15-28-24(32)22(30)23(31)25(33)29-13-3-6-21(29)16-9-11-27-12-10-16;1-26-24-28-18(13-35-24)19-7-4-8-29(19)23(33)21(31)20(30)22(32)27-11-16-10-14(12-34-16)9-15-5-2-3-6-17(15)25;1-14-27-19(13-33-14)20-7-4-8-28(20)24(32)22(30)21(29)23(31)26-11-17-10-15(12-34-17)9-16-5-2-3-6-18(16)25;1-15-26-19(14-32-15)20-8-5-9-27(20)24(31)22(29)21(28)23(30)25-12-18-11-17(13-33-18)10-16-6-3-2-4-7-16;1-15-13-33-23(26-15)19-8-5-9-27(19)24(31)21(29)20(28)22(30)25-12-18-11-17(14-32-18)10-16-6-3-2-4-7-16;24-16-5-2-1-4-13(16)10-14-7-8-15(34-14)11-26-21(31)19(29)20(30)22(32)28-9-3-6-18(28)17-12-33-23(25)27-17;24-17-5-2-1-4-15(17)8-14-9-16(33-11-14)10-25-22(30)20(28)21(29)23(31)27-7-3-6-19(27)18-12-32-13-26-18;29-18(21(32)25-10-7-15-3-2-12-34-15)19(30)22(33)28-11-1-4-17(28)16-13-35-23(26-16)27-20(31)14-5-8-24-9-6-14;24-23-26-17(13-33-23)18-7-4-8-27(18)22(31)20(29)19(28)21(30)25-11-16-10-15(12-32-16)9-14-5-2-1-3-6-14;1-25(2)11-16(27)24-21-23-14(12-33-21)15-6-3-9-26(15)20(31)18(29)17(28)19(30)22-8-7-13-5-4-10-32-13;18-17-20-11(9-27-17)12-4-1-7-21(12)16(25)14(23)13(22)15(24)19-6-5-10-3-2-8-26-10/h5-6,8-11,14,18,25,27-28,35-36H,7,12-13,15-17H2,1-4H3,(H,31,37);1-3,5-7,9-11,14,21-23,30-31H,4,8,12-13,15H2,(H,28,32);1-4,6-8,10-12,21-23,30-31H,5,9,13-15H2,(H,28,32);1-2,4-5,7-12,21-23,30-31H,3,6,13-15H2,(H,28,32);2-3,5-6,10,12-13,19-21,30-31H,4,7-9,11H2,1H3,(H,26,28)(H,27,32);2-3,5-6,10,12-13,20-22,29-30H,4,7-9,11H2,1H3,(H,26,31);2-4,6-7,11,13-14,20-22,28-29H,5,8-10,12H2,1H3,(H,25,30);2-4,6-7,11,13-14,19-21,28-29H,5,8-10,12H2,1H3,(H,25,30);1-2,4-5,7-8,12,18-20,29-30H,3,6,9-11H2,(H2,25,27)(H,26,31);1-2,4-5,9,11-13,19-21,28-29H,3,6-8,10H2,(H,25,30);2-3,12-14,17-19,24,29-30H,1,4-11H2,(H,25,32)(H,26,27,31);1-3,5-6,10,12-13,18-20,28-29H,4,7-9,11H2,(H2,24,26)(H,25,30);4-5,10,12,15,17-18,28-29H,3,6-9,11H2,1-2H3,(H,22,30)(H,23,24,27);2-3,8-9,12-14,22-23H,1,4-7H2,(H2,18,20)(H,19,24)/t25?,27-,28-;3*21?,22-,23-;19-,20-,21-;2*20-,21-,22-;19-,20-,21-;18-,19-,20-;19-,20-,21-;17-,18-,19-;18-,19-,20-;15-,17-,18-;12-,13-,14-/m11111111111111/s1.

What are the key properties of (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide?

(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide has a molecular weight of 7018.76 g/mol, XLogP of 34.47, 117 rotatable bonds, 49 hydrogen bond donors, and 103 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-4-[(2R)-2-(2-amino-1,3-thiazol-4-yl)pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[(4-benzylthiophen-2-yl)methyl]-2,3-dihydroxy-4-[(2R)-2-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-[(2R)-2-(2-methyl-1,3-thiazol-4-yl)pyrrolidin-1-yl]-4-oxobutanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-2-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-3-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[5-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanamide;(2R,3R)-N-[[4-[(2-chlorophenyl)methyl]thiophen-2-yl]methyl]-2,3-dihydroxy-4-oxo-4-[(2R)-2-(1,3-thiazol-4-yl)pyrrolidin-1-yl]butanamide;N-[4-[(2R)-1-[(2R,3R)-2,3-dihydroxy-4-oxo-4-(2-thiophen-2-ylethylamino)butanoyl]pyrrolidin-2-yl]-1,3-thiazol-2-yl]piperidine-4-carboxamide;(2R,3R)-4-[(2R)-2-[2-[[2-(dimethylamino)acetyl]amino]-1,3-thiazol-4-yl]pyrrolidin-1-yl]-2,3-dihydroxy-4-oxo-N-(2-thiophen-2-ylethyl)butanamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-N-[[4-[(2,6-dimethylphenyl)methyl]-1,3-thiazol-2-yl]methyl]-2,3-dihydroxy-4-oxobutanamide is sourced from PubChem (CID 159322847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).