(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide

C189H215ClF3N29O30S4 — CID 162233933

About (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide

(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide (PubChem CID 162233933) has the molecular formula C189H215ClF3N29O30S4 and a molecular weight of 3593.69 g/mol. Its IUPAC name is (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide.

Molecular Properties

• Compound Name: (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide
• PubChem CID: 162233933
• Molecular Formula: C189H215ClF3N29O30S4
• Molecular Weight: 3593.69 g/mol
• Exact Mass: 3590.47
• IUPAC Name: (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide
• SMILES: CC(C)CNC(=O)c1sccc1-c1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCC[C@@H]2c2ccccc2)cc1.CC(C)NC(=O)c1sccc1-c1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCC[C@@H]2c2ccccc2)cc1.Cc1nc2c(s1)CN(C(=O)[C@H](O)[C@@H](O)C(=O)NCC1CCN(c3ccc(F)cc3C#N)CC1)C2.Cc1nc2ccccc2n1Cc1csc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(CN(C)C)c2)n1.N#Cc1c(F)cccc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2Cc3ccccc3C2)CC1.N#Cc1ccc(F)cc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2Cc3ccccc3C2)CC1.N#Cc1ccccc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(Cl)c2)CC1
• InChI: InChI=1S/C30H36N6O4S.C30H35N3O5S.C29H33N3O5S.C27H31ClN4O4.2C25H27FN4O4.C23H26FN5O4S/c1-19-32-23-10-4-5-11-25(23)36(19)17-22-18-41-26(33-22)15-31-29(39)27(37)28(38)30(40)35-13-7-12-24(35)21-9-6-8-20(14-21)16-34(2)3;1-19(2)17-31-29(37)27-23(14-16-39-27)21-12-10-20(11-13-21)18-32-28(36)25(34)26(35)30(38)33-15-6-9-24(33)22-7-4-3-5-8-22;1-18(2)31-28(36)26-22(14-16-38-26)20-12-10-19(11-13-20)17-30-27(35)24(33)25(34)29(37)32-15-6-9-23(32)21-7-4-3-5-8-21;28-21-7-3-6-19(15-21)23-9-4-12-32(23)27(36)25(34)24(33)26(35)30-17-18-10-13-31(14-11-18)22-8-2-1-5-20(22)16-29;26-20-6-3-7-21(19(20)12-27)29-10-8-16(9-11-29)13-28-24(33)22(31)23(32)25(34)30-14-17-4-1-2-5-18(17)15-30;26-20-6-5-17(12-27)21(11-20)29-9-7-16(8-10-29)13-28-24(33)22(31)23(32)25(34)30-14-18-3-1-2-4-19(18)15-30;1-13-27-17-11-29(12-19(17)34-13)23(33)21(31)20(30)22(32)26-10-14-4-6-28(7-5-14)18-3-2-16(24)8-15(18)9-25/h4-6,8-11,14,18,24,27-28,37-38H,7,12-13,15-17H2,1-3H3,(H,31,39);3-5,7-8,10-14,16,19,24-26,34-35H,6,9,15,17-18H2,1-2H3,(H,31,37)(H,32,36);3-5,7-8,10-14,16,18,23-25,33-34H,6,9,15,17H2,1-2H3,(H,30,35)(H,31,36);1-3,5-8,15,18,23-25,33-34H,4,9-14,17H2,(H,30,35);1-7,16,22-23,31-32H,8-11,13-15H2,(H,28,33);1-6,11,16,22-23,31-32H,7-10,13-15H2,(H,28,33);2-3,8,14,20-21,30-31H,4-7,10-12H2,1H3,(H,26,32)/t24?,27-,28-;24-,25-,26-;23-,24-,25-;23?,24-,25-;2*22-,23-;20-,21-/m1111111/s1
• InChIKey: ZVUUCWFCCBVJGT-DPCWLOSJSA-N
• XLogP: 15.65
• TPSA: 842.25 Ų
• H-Bond Donors: 23
• H-Bond Acceptors: 47
• Rotatable Bonds: 54
• Heavy Atoms: 256
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3593.69
LogP ≤ 5	15.65
H-Bond Donors ≤ 5	23
H-Bond Acceptors ≤ 10	47

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide?

The IUPAC name of (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide (CID 162233933) is (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide.

What is the SMILES notation for (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide?

The canonical SMILES for (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide is CC(C)CNC(=O)c1sccc1-c1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCC[C@@H]2c2ccccc2)cc1.CC(C)NC(=O)c1sccc1-c1ccc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCC[C@@H]2c2ccccc2)cc1.Cc1nc2c(s1)CN(C(=O)[C@H](O)[C@@H](O)C(=O)NCC1CCN(c3ccc(F)cc3C#N)CC1)C2.Cc1nc2ccccc2n1Cc1csc(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(CN(C)C)c2)n1.N#Cc1c(F)cccc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2Cc3ccccc3C2)CC1.N#Cc1ccc(F)cc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2Cc3ccccc3C2)CC1.N#Cc1ccccc1N1CCC(CNC(=O)[C@H](O)[C@@H](O)C(=O)N2CCCC2c2cccc(Cl)c2)CC1.

What is the InChIKey of (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide?

The InChIKey is ZVUUCWFCCBVJGT-DPCWLOSJSA-N. The full InChI is InChI=1S/C30H36N6O4S.C30H35N3O5S.C29H33N3O5S.C27H31ClN4O4.2C25H27FN4O4.C23H26FN5O4S/c1-19-32-23-10-4-5-11-25(23)36(19)17-22-18-41-26(33-22)15-31-29(39)27(37)28(38)30(40)35-13-7-12-24(35)21-9-6-8-20(14-21)16-34(2)3;1-19(2)17-31-29(37)27-23(14-16-39-27)21-12-10-20(11-13-21)18-32-28(36)25(34)26(35)30(38)33-15-6-9-24(33)22-7-4-3-5-8-22;1-18(2)31-28(36)26-22(14-16-38-26)20-12-10-19(11-13-20)17-30-27(35)24(33)25(34)29(37)32-15-6-9-23(32)21-7-4-3-5-8-21;28-21-7-3-6-19(15-21)23-9-4-12-32(23)27(36)25(34)24(33)26(35)30-17-18-10-13-31(14-11-18)22-8-2-1-5-20(22)16-29;26-20-6-3-7-21(19(20)12-27)29-10-8-16(9-11-29)13-28-24(33)22(31)23(32)25(34)30-14-17-4-1-2-5-18(17)15-30;26-20-6-5-17(12-27)21(11-20)29-9-7-16(8-10-29)13-28-24(33)22(31)23(32)25(34)30-14-18-3-1-2-4-19(18)15-30;1-13-27-17-11-29(12-19(17)34-13)23(33)21(31)20(30)22(32)26-10-14-4-6-28(7-5-14)18-3-2-16(24)8-15(18)9-25/h4-6,8-11,14,18,24,27-28,37-38H,7,12-13,15-17H2,1-3H3,(H,31,39);3-5,7-8,10-14,16,19,24-26,34-35H,6,9,15,17-18H2,1-2H3,(H,31,37)(H,32,36);3-5,7-8,10-14,16,18,23-25,33-34H,6,9,15,17H2,1-2H3,(H,30,35)(H,31,36);1-3,5-8,15,18,23-25,33-34H,4,9-14,17H2,(H,30,35);1-7,16,22-23,31-32H,8-11,13-15H2,(H,28,33);1-6,11,16,22-23,31-32H,7-10,13-15H2,(H,28,33);2-3,8,14,20-21,30-31H,4-7,10-12H2,1H3,(H,26,32)/t24?,27-,28-;24-,25-,26-;23-,24-,25-;23?,24-,25-;2*22-,23-;20-,21-/m1111111/s1.

What are the key properties of (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide?

(2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide has a molecular weight of 3593.69 g/mol, XLogP of 15.65, 54 rotatable bonds, 23 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3R)-4-[2-(3-chlorophenyl)pyrrolidin-1-yl]-N-[[1-(2-cyanophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-3-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-5-fluorophenyl)piperidin-4-yl]methyl]-4-(1,3-dihydroisoindol-2-yl)-2,3-dihydroxy-4-oxobutanamide;(2R,3R)-N-[[1-(2-cyano-4-fluorophenyl)piperidin-4-yl]methyl]-2,3-dihydroxy-4-(2-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-5-yl)-4-oxobutanamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-(2-methylpropyl)thiophene-2-carboxamide;3-[4-[[[(2R,3R)-2,3-dihydroxy-4-oxo-4-[(2R)-2-phenylpyrrolidin-1-yl]butanoyl]amino]methyl]phenyl]-N-propan-2-ylthiophene-2-carboxamide;(2R,3R)-4-[2-[3-[(dimethylamino)methyl]phenyl]pyrrolidin-1-yl]-2,3-dihydroxy-N-[[4-[(2-methylbenzimidazol-1-yl)methyl]-1,3-thiazol-2-yl]methyl]-4-oxobutanamide is sourced from PubChem (CID 162233933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).