(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide

C138H164N36O24S3 — CID 159581929

About (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide

(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide (PubChem CID 159581929) has the molecular formula C138H164N36O24S3 and a molecular weight of 2807.26 g/mol. Its IUPAC name is (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide.

Molecular Properties

• Compound Name: (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide
• PubChem CID: 159581929
• Molecular Formula: C138H164N36O24S3
• Molecular Weight: 2807.26 g/mol
• Exact Mass: 2805.19
• IUPAC Name: (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide
• SMILES: CNc1nc([C@H]2C=CCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cs1.CNc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cs1.CNc1nccc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)n1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCCC1(C)c1nccs1)c1ccc(-n2cccn2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccn(C)n1)c1ccc(-n2cccn2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccn[nH]1)c1ccc(-n2cccn2)cc1
• InChI: InChI=1S/C24H29N7O4.C23H28N6O4S.C23H26N6O4S.C23H28N6O4.C23H27N5O4S.C22H26N6O4/c1-15(16-6-8-17(9-7-16)31-14-4-11-27-31)28-22(34)20(32)21(33)23(35)30-13-3-5-19(30)18-10-12-26-24(25-2)29-18;2*1-14(15-6-8-16(9-7-15)29-12-4-10-25-29)26-21(32)19(30)20(31)22(33)28-11-3-5-18(28)17-13-34-23(24-2)27-17;1-15(16-6-8-17(9-7-16)29-13-4-11-24-29)25-22(32)20(30)21(31)23(33)28-12-3-5-19(28)18-10-14-27(2)26-18;1-15(16-5-7-17(8-6-16)28-13-4-10-25-28)26-20(31)18(29)19(30)21(32)27-12-3-9-23(27,2)22-24-11-14-33-22;1-14(15-5-7-16(8-6-15)28-13-3-10-24-28)25-21(31)19(29)20(30)22(32)27-12-2-4-18(27)17-9-11-23-26-17/h4,6-12,14-15,19-21,32-33H,3,5,13H2,1-2H3,(H,28,34)(H,25,26,29);4,6-10,12-14,18-20,30-31H,3,5,11H2,1-2H3,(H,24,27)(H,26,32);3-10,12-14,18-20,30-31H,11H2,1-2H3,(H,24,27)(H,26,32);4,6-11,13-15,19-21,30-31H,3,5,12H2,1-2H3,(H,25,32);4-8,10-11,13-15,18-19,29-30H,3,9,12H2,1-2H3,(H,26,31);3,5-11,13-14,18-20,29-30H,2,4,12H2,1H3,(H,23,26)(H,25,31)/t15-,19-,20-,21-;2*14-,18-,19-,20-;15-,19-,20-,21-;15-,18-,19-,23?;14-,18-,19-,20-/m111111/s1
• InChIKey: MJCXGQNBGWOEHA-GFVDVQJZSA-N
• XLogP: 7.50
• TPSA: 793.18 Ų
• H-Bond Donors: 22
• H-Bond Acceptors: 50
• Rotatable Bonds: 45
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2807.26
LogP ≤ 5	7.50
H-Bond Donors ≤ 5	22
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide?

The IUPAC name of (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide (CID 159581929) is (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide.

What is the SMILES notation for (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide?

The canonical SMILES for (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide is CNc1nc([C@H]2C=CCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cs1.CNc1nc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)cs1.CNc1nccc([C@H]2CCCN2C(=O)[C@H](O)[C@@H](O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)n1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCCC1(C)c1nccs1)c1ccc(-n2cccn2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccn(C)n1)c1ccc(-n2cccn2)cc1.C[C@@H](NC(=O)[C@H](O)[C@@H](O)C(=O)N1CCC[C@@H]1c1ccn[nH]1)c1ccc(-n2cccn2)cc1.

What is the InChIKey of (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide?

The InChIKey is MJCXGQNBGWOEHA-GFVDVQJZSA-N. The full InChI is InChI=1S/C24H29N7O4.C23H28N6O4S.C23H26N6O4S.C23H28N6O4.C23H27N5O4S.C22H26N6O4/c1-15(16-6-8-17(9-7-16)31-14-4-11-27-31)28-22(34)20(32)21(33)23(35)30-13-3-5-19(30)18-10-12-26-24(25-2)29-18;2*1-14(15-6-8-16(9-7-15)29-12-4-10-25-29)26-21(32)19(30)20(31)22(33)28-11-3-5-18(28)17-13-34-23(24-2)27-17;1-15(16-6-8-17(9-7-16)29-13-4-11-24-29)25-22(32)20(30)21(31)23(33)28-12-3-5-19(28)18-10-14-27(2)26-18;1-15(16-5-7-17(8-6-16)28-13-4-10-25-28)26-20(31)18(29)19(30)21(32)27-12-3-9-23(27,2)22-24-11-14-33-22;1-14(15-5-7-16(8-6-15)28-13-3-10-24-28)25-21(31)19(29)20(30)22(32)27-12-2-4-18(27)17-9-11-23-26-17/h4,6-12,14-15,19-21,32-33H,3,5,13H2,1-2H3,(H,28,34)(H,25,26,29);4,6-10,12-14,18-20,30-31H,3,5,11H2,1-2H3,(H,24,27)(H,26,32);3-10,12-14,18-20,30-31H,11H2,1-2H3,(H,24,27)(H,26,32);4,6-11,13-15,19-21,30-31H,3,5,12H2,1-2H3,(H,25,32);4-8,10-11,13-15,18-19,29-30H,3,9,12H2,1-2H3,(H,26,31);3,5-11,13-14,18-20,29-30H,2,4,12H2,1H3,(H,23,26)(H,25,31)/t15-,19-,20-,21-;2*14-,18-,19-,20-;15-,19-,20-,21-;15-,18-,19-,23?;14-,18-,19-,20-/m111111/s1.

What are the key properties of (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide?

(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide has a molecular weight of 2807.26 g/mol, XLogP of 7.50, 45 rotatable bonds, 22 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]-2,5-dihydropyrrol-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-[2-(methylamino)-1,3-thiazol-4-yl]pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[(2R)-2-(1-methylpyrazol-3-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-[2-methyl-2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]butanamide;(2R,3R)-2,3-dihydroxy-4-oxo-N-[(1R)-1-(4-pyrazol-1-ylphenyl)ethyl]-4-[(2R)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]butanamide is sourced from PubChem (CID 159581929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).