sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride

C148H143BBrClF19N24NaO16 — CID 159028147

About sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride

sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride (PubChem CID 159028147) has the molecular formula C148H143BBrClF19N24NaO16 and a molecular weight of 3024.04 g/mol. Its IUPAC name is sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride.

Molecular Properties

• Compound Name: sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride
• PubChem CID: 159028147
• Molecular Formula: C148H143BBrClF19N24NaO16
• Molecular Weight: 3024.04 g/mol
• Exact Mass: 3020.97
• IUPAC Name: sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride
• SMILES: C.C.C1CCOC1.COC1=N[C@H](C(C)C)C(OC)=N[C@H]1Cc1ccc(B2OC(C)(C)C(C)(C)O2)c2nccn12.Cl.[C-]#[N+]c1ccc(-c2ccc(C[C@@H]3N=C(OC)[C@@H](C(C)C)N=C3OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](N)C(=O)OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](NC(=O)c3c(F)cc(N[C@@H](C)c4ccccc4)cc3F)C(=O)O)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](NC(=O)c3c(F)cc(N[C@@H](C)c4ccccc4)cc3F)C(=O)OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(Br)c(C(F)(F)F)c1.[Na+].[OH-]
• InChI: InChI=1S/C34H26F5N5O3.C33H24F5N5O3.C25H24F3N5O2.C23H33BN4O4.C19H15F3N4O2.C8H3BrF3N.C4H8O.2CH4.ClH.Na.H2O/c1-19(20-7-5-4-6-8-20)42-22-16-27(35)30(28(36)17-22)32(45)43-29(33(46)47-3)18-23-10-12-25(31-41-13-14-44(23)31)24-11-9-21(40-2)15-26(24)34(37,38)39;1-18(19-6-4-3-5-7-19)41-21-15-26(34)29(27(35)16-21)31(44)42-28(32(45)46)17-22-9-11-24(30-40-12-13-43(22)30)23-10-8-20(39-2)14-25(23)33(36,37)38;1-14(2)21-24(35-5)31-20(23(32-21)34-4)13-16-7-9-18(22-30-10-11-33(16)22)17-8-6-15(29-3)12-19(17)25(26,27)28;1-14(2)18-21(30-8)26-17(20(27-18)29-7)13-15-9-10-16(19-25-11-12-28(15)19)24-31-22(3,4)23(5,6)32-24;1-24-11-3-5-13(15(9-11)19(20,21)22)14-6-4-12(10-16(23)18(27)28-2)26-8-7-25-17(14)26;1-13-5-2-3-7(9)6(4-5)8(10,11)12;1-2-4-5-3-1;;;;;/h4-17,19,29,42H,18H2,1,3H3,(H,43,45);3-16,18,28,41H,17H2,1H3,(H,42,44)(H,45,46);6-12,14,20-21H,13H2,1-2,4-5H3;9-12,14,17-18H,13H2,1-8H3;3-9,16H,10,23H2,2H3;2-4H;1-4H2;2*1H4;1H;;1H2/q;;;;;;;;;;+1;/p-1/t19-,29-;18-,28-;20-,21+;17-,18+;16-;;;;;;;/m00000......./s1
• InChIKey: NGJJEPBKVHBVMC-HQQGBVOESA-M
• XLogP: 30.22
• TPSA: 450.53 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 32
• Rotatable Bonds: 30
• Heavy Atoms: 211
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3024.04
LogP ≤ 5	30.22
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride?

The IUPAC name of sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride (CID 159028147) is sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride.

What is the SMILES notation for sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride?

The canonical SMILES for sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride is C.C.C1CCOC1.COC1=N[C@H](C(C)C)C(OC)=N[C@H]1Cc1ccc(B2OC(C)(C)C(C)(C)O2)c2nccn12.Cl.[C-]#[N+]c1ccc(-c2ccc(C[C@@H]3N=C(OC)[C@@H](C(C)C)N=C3OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](N)C(=O)OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](NC(=O)c3c(F)cc(N[C@@H](C)c4ccccc4)cc3F)C(=O)O)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(-c2ccc(C[C@H](NC(=O)c3c(F)cc(N[C@@H](C)c4ccccc4)cc3F)C(=O)OC)n3ccnc23)c(C(F)(F)F)c1.[C-]#[N+]c1ccc(Br)c(C(F)(F)F)c1.[Na+].[OH-].

What is the InChIKey of sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride?

The InChIKey is NGJJEPBKVHBVMC-HQQGBVOESA-M. The full InChI is InChI=1S/C34H26F5N5O3.C33H24F5N5O3.C25H24F3N5O2.C23H33BN4O4.C19H15F3N4O2.C8H3BrF3N.C4H8O.2CH4.ClH.Na.H2O/c1-19(20-7-5-4-6-8-20)42-22-16-27(35)30(28(36)17-22)32(45)43-29(33(46)47-3)18-23-10-12-25(31-41-13-14-44(23)31)24-11-9-21(40-2)15-26(24)34(37,38)39;1-18(19-6-4-3-5-7-19)41-21-15-26(34)29(27(35)16-21)31(44)42-28(32(45)46)17-22-9-11-24(30-40-12-13-43(22)30)23-10-8-20(39-2)14-25(23)33(36,37)38;1-14(2)21-24(35-5)31-20(23(32-21)34-4)13-16-7-9-18(22-30-10-11-33(16)22)17-8-6-15(29-3)12-19(17)25(26,27)28;1-14(2)18-21(30-8)26-17(20(27-18)29-7)13-15-9-10-16(19-25-11-12-28(15)19)24-31-22(3,4)23(5,6)32-24;1-24-11-3-5-13(15(9-11)19(20,21)22)14-6-4-12(10-16(23)18(27)28-2)26-8-7-25-17(14)26;1-13-5-2-3-7(9)6(4-5)8(10,11)12;1-2-4-5-3-1;;;;;/h4-17,19,29,42H,18H2,1,3H3,(H,43,45);3-16,18,28,41H,17H2,1H3,(H,42,44)(H,45,46);6-12,14,20-21H,13H2,1-2,4-5H3;9-12,14,17-18H,13H2,1-8H3;3-9,16H,10,23H2,2H3;2-4H;1-4H2;2*1H4;1H;;1H2/q;;;;;;;;;;+1;/p-1/t19-,29-;18-,28-;20-,21+;17-,18+;16-;;;;;;;/m00000......./s1.

What are the key properties of sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride?

sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride has a molecular weight of 3024.04 g/mol, XLogP of 30.22, 30 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;1-bromo-4-isocyano-2-(trifluoromethyl)benzene;(2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoic acid;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine;5-[[(2S,5R)-3,6-dimethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine;methane;methyl (2S)-2-amino-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[[(1S)-1-phenylethyl]amino]benzoyl]amino]-3-[8-[4-isocyano-2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-5-yl]propanoate;oxolane;hydroxide;hydrochloride is sourced from PubChem (CID 159028147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).