(2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid

C159H135BrF19N19O27 — CID 163768203

About (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid

(2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid (PubChem CID 163768203) has the molecular formula C159H135BrF19N19O27 and a molecular weight of 3184.80 g/mol. Its IUPAC name is (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid.

Molecular Properties

• Compound Name: (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid
• PubChem CID: 163768203
• Molecular Formula: C159H135BrF19N19O27
• Molecular Weight: 3184.80 g/mol
• Exact Mass: 3181.87
• IUPAC Name: (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid
• SMILES: COc1c(C(=O)N[C@@H](Cc2ccc(-c3c(C(F)(F)F)cc(C)n(C)c3=O)cc2)C(=O)O)[nH]c2ccccc12.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3Br)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3C=O)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3CO)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3F)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3N)C(=O)O)cc2)c(=O)n1C
• InChI: InChI=1S/2C27H24F3N3O5.C27H22F3N3O5.C26H21BrF3N3O4.C26H21F4N3O4.C26H23F3N4O4/c1-14-12-18(27(28,29)30)21(25(35)33(14)2)16-10-8-15(9-11-16)13-20(26(36)37)32-24(34)22-23(38-3)17-6-4-5-7-19(17)31-22;2*1-14-11-19(27(28,29)30)22(25(36)33(14)2)16-9-7-15(8-10-16)12-21(26(37)38)32-24(35)23-18(13-34)17-5-3-4-6-20(17)31-23;2*1-13-11-17(26(28,29)30)20(24(35)33(13)2)15-9-7-14(8-10-15)12-19(25(36)37)32-23(34)22-21(27)16-5-3-4-6-18(16)31-22;1-13-11-17(26(27,28)29)20(24(35)33(13)2)15-9-7-14(8-10-15)12-19(25(36)37)32-23(34)22-21(30)16-5-3-4-6-18(16)31-22/h4-12,20,31H,13H2,1-3H3,(H,32,34)(H,36,37);3-11,21,31,34H,12-13H2,1-2H3,(H,32,35)(H,37,38);3-11,13,21,31H,12H2,1-2H3,(H,32,35)(H,37,38);2*3-11,19,31H,12H2,1-2H3,(H,32,34)(H,36,37);3-11,19,31H,12,30H2,1-2H3,(H,32,34)(H,36,37)/t20-;2*21-;3*19-/m000000/s1
• InChIKey: MEEGWNDQGKMUDE-QDUMEQLVSA-N
• XLogP: 25.52
• TPSA: 697.69 Ų
• H-Bond Donors: 20
• H-Bond Acceptors: 28
• Rotatable Bonds: 39
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3184.80
LogP ≤ 5	25.52
H-Bond Donors ≤ 5	20
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid?

The IUPAC name of (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid (CID 163768203) is (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid.

What is the SMILES notation for (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid?

The canonical SMILES for (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid is COc1c(C(=O)N[C@@H](Cc2ccc(-c3c(C(F)(F)F)cc(C)n(C)c3=O)cc2)C(=O)O)[nH]c2ccccc12.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3Br)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3C=O)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3CO)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3F)C(=O)O)cc2)c(=O)n1C.Cc1cc(C(F)(F)F)c(-c2ccc(C[C@H](NC(=O)c3[nH]c4ccccc4c3N)C(=O)O)cc2)c(=O)n1C.

What is the InChIKey of (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid?

The InChIKey is MEEGWNDQGKMUDE-QDUMEQLVSA-N. The full InChI is InChI=1S/2C27H24F3N3O5.C27H22F3N3O5.C26H21BrF3N3O4.C26H21F4N3O4.C26H23F3N4O4/c1-14-12-18(27(28,29)30)21(25(35)33(14)2)16-10-8-15(9-11-16)13-20(26(36)37)32-24(34)22-23(38-3)17-6-4-5-7-19(17)31-22;2*1-14-11-19(27(28,29)30)22(25(36)33(14)2)16-9-7-15(8-10-16)12-21(26(37)38)32-24(35)23-18(13-34)17-5-3-4-6-20(17)31-23;2*1-13-11-17(26(28,29)30)20(24(35)33(13)2)15-9-7-14(8-10-15)12-19(25(36)37)32-23(34)22-21(27)16-5-3-4-6-18(16)31-22;1-13-11-17(26(27,28)29)20(24(35)33(13)2)15-9-7-14(8-10-15)12-19(25(36)37)32-23(34)22-21(30)16-5-3-4-6-18(16)31-22/h4-12,20,31H,13H2,1-3H3,(H,32,34)(H,36,37);3-11,21,31,34H,12-13H2,1-2H3,(H,32,35)(H,37,38);3-11,13,21,31H,12H2,1-2H3,(H,32,35)(H,37,38);2*3-11,19,31H,12H2,1-2H3,(H,32,34)(H,36,37);3-11,19,31H,12,30H2,1-2H3,(H,32,34)(H,36,37)/t20-;2*21-;3*19-/m000000/s1.

What are the key properties of (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid?

(2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid has a molecular weight of 3184.80 g/mol, XLogP of 25.52, 39 rotatable bonds, 20 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-[(3-amino-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-2-[(3-bromo-1H-indole-2-carbonyl)amino]-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-fluoro-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-formyl-1H-indole-2-carbonyl)amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[[3-(hydroxymethyl)-1H-indole-2-carbonyl]amino]propanoic acid;(2S)-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]phenyl]-2-[(3-methoxy-1H-indole-2-carbonyl)amino]propanoic acid is sourced from PubChem (CID 163768203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).