1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate

C176H204F6N30O30 — CID 159276951

About 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate

1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate (PubChem CID 159276951) has the molecular formula C176H204F6N30O30 and a molecular weight of 3333.74 g/mol. Its IUPAC name is 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate.

Molecular Properties

• Compound Name: 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate
• PubChem CID: 159276951
• Molecular Formula: C176H204F6N30O30
• Molecular Weight: 3333.74 g/mol
• Exact Mass: 3331.53
• IUPAC Name: 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate
• SMILES: CC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4c(cnn4C(=O)OC(C)(C)C)n3)CCCCC2)cc1.CC(=O)c1ccc(C2(C(=O)O)CCCCC2)cc1.CC(C)(C)OC(=O)n1ncc2nc(NC(=O)[C@H]3C[C@@H](F)CN3)ccc21.CC(C)(C)OC(=O)n1ncc2nc(NC(=O)[C@H]3C[C@@H](F)CN3C(=O)C3(c4ccc(C(=O)O)cc4)CCCCC3)ccc21.CC(C)(O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cc1.COC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cc1.COC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4c(cnn4C(=O)OC(C)(C)C)n3)CCCCC2)cc1
• InChI: InChI=1S/C31H36FN5O6.C31H36FN5O5.C30H34FN5O6.C27H32FN5O3.C26H28FN5O4.C16H20FN5O3.C15H18O3/c1-30(2,3)43-29(41)37-23-12-13-25(34-22(23)17-33-37)35-26(38)24-16-21(32)18-36(24)28(40)31(14-6-5-7-15-31)20-10-8-19(9-11-20)27(39)42-4;1-19(38)20-8-10-21(11-9-20)31(14-6-5-7-15-31)28(40)36-18-22(32)16-25(36)27(39)35-26-13-12-24-23(34-26)17-33-37(24)29(41)42-30(2,3)4;1-29(2,3)42-28(41)36-22-11-12-24(33-21(22)16-32-36)34-25(37)23-15-20(31)17-35(23)27(40)30(13-5-4-6-14-30)19-9-7-18(8-10-19)26(38)39;1-26(2,36)17-6-8-18(9-7-17)27(12-4-3-5-13-27)25(35)33-16-19(28)14-22(33)24(34)31-23-11-10-20-21(30-23)15-29-32-20;1-36-24(34)16-5-7-17(8-6-16)26(11-3-2-4-12-26)25(35)32-15-18(27)13-21(32)23(33)30-22-10-9-19-20(29-22)14-28-31-19;1-16(2,3)25-15(24)22-12-4-5-13(20-11(12)8-19-22)21-14(23)10-6-9(17)7-18-10;1-11(16)12-5-7-13(8-6-12)15(14(17)18)9-3-2-4-10-15/h8-13,17,21,24H,5-7,14-16,18H2,1-4H3,(H,34,35,38);8-13,17,22,25H,5-7,14-16,18H2,1-4H3,(H,34,35,39);7-12,16,20,23H,4-6,13-15,17H2,1-3H3,(H,38,39)(H,33,34,37);6-11,15,19,22,36H,3-5,12-14,16H2,1-2H3,(H,29,32)(H,30,31,34);5-10,14,18,21H,2-4,11-13,15H2,1H3,(H,28,31)(H,29,30,33);4-5,8-10,18H,6-7H2,1-3H3,(H,20,21,23);5-8H,2-4,9-10H2,1H3,(H,17,18)/t21-,24-;22-,25-;20-,23-;19-,22-;18-,21-;9-,10-;/m111111./s1
• InChIKey: KYKVVXDLQZMPEO-NUFKUBCSSA-N
• XLogP: 27.19
• TPSA: 780.93 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 45
• Rotatable Bonds: 30
• Heavy Atoms: 242
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3333.74
LogP ≤ 5	27.19
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate?

The IUPAC name of 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate (CID 159276951) is 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate.

What is the SMILES notation for 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate?

The canonical SMILES for 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate is CC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4c(cnn4C(=O)OC(C)(C)C)n3)CCCCC2)cc1.CC(=O)c1ccc(C2(C(=O)O)CCCCC2)cc1.CC(C)(C)OC(=O)n1ncc2nc(NC(=O)[C@H]3C[C@@H](F)CN3)ccc21.CC(C)(C)OC(=O)n1ncc2nc(NC(=O)[C@H]3C[C@@H](F)CN3C(=O)C3(c4ccc(C(=O)O)cc4)CCCCC3)ccc21.CC(C)(O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cc1.COC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4[nH]ncc4n3)CCCCC2)cc1.COC(=O)c1ccc(C2(C(=O)N3C[C@H](F)C[C@@H]3C(=O)Nc3ccc4c(cnn4C(=O)OC(C)(C)C)n3)CCCCC2)cc1.

What is the InChIKey of 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate?

The InChIKey is KYKVVXDLQZMPEO-NUFKUBCSSA-N. The full InChI is InChI=1S/C31H36FN5O6.C31H36FN5O5.C30H34FN5O6.C27H32FN5O3.C26H28FN5O4.C16H20FN5O3.C15H18O3/c1-30(2,3)43-29(41)37-23-12-13-25(34-22(23)17-33-37)35-26(38)24-16-21(32)18-36(24)28(40)31(14-6-5-7-15-31)20-10-8-19(9-11-20)27(39)42-4;1-19(38)20-8-10-21(11-9-20)31(14-6-5-7-15-31)28(40)36-18-22(32)16-25(36)27(39)35-26-13-12-24-23(34-26)17-33-37(24)29(41)42-30(2,3)4;1-29(2,3)42-28(41)36-22-11-12-24(33-21(22)16-32-36)34-25(37)23-15-20(31)17-35(23)27(40)30(13-5-4-6-14-30)19-9-7-18(8-10-19)26(38)39;1-26(2,36)17-6-8-18(9-7-17)27(12-4-3-5-13-27)25(35)33-16-19(28)14-22(33)24(34)31-23-11-10-20-21(30-23)15-29-32-20;1-36-24(34)16-5-7-17(8-6-16)26(11-3-2-4-12-26)25(35)32-15-18(27)13-21(32)23(33)30-22-10-9-19-20(29-22)14-28-31-19;1-16(2,3)25-15(24)22-12-4-5-13(20-11(12)8-19-22)21-14(23)10-6-9(17)7-18-10;1-11(16)12-5-7-13(8-6-12)15(14(17)18)9-3-2-4-10-15/h8-13,17,21,24H,5-7,14-16,18H2,1-4H3,(H,34,35,38);8-13,17,22,25H,5-7,14-16,18H2,1-4H3,(H,34,35,39);7-12,16,20,23H,4-6,13-15,17H2,1-3H3,(H,38,39)(H,33,34,37);6-11,15,19,22,36H,3-5,12-14,16H2,1-2H3,(H,29,32)(H,30,31,34);5-10,14,18,21H,2-4,11-13,15H2,1H3,(H,28,31)(H,29,30,33);4-5,8-10,18H,6-7H2,1-3H3,(H,20,21,23);5-8H,2-4,9-10H2,1H3,(H,17,18)/t21-,24-;22-,25-;20-,23-;19-,22-;18-,21-;9-,10-;/m111111./s1.

What are the key properties of 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate?

1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate has a molecular weight of 3333.74 g/mol, XLogP of 27.19, 30 rotatable bonds, 12 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-acetylphenyl)cyclohexane-1-carboxylic acid;tert-butyl 5-[[(2R,4R)-1-[1-(4-acetylphenyl)cyclohexanecarbonyl]-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoro-1-[1-(4-methoxycarbonylphenyl)cyclohexanecarbonyl]pyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;tert-butyl 5-[[(2R,4R)-4-fluoropyrrolidine-2-carbonyl]amino]pyrazolo[4,5-b]pyridine-1-carboxylate;(2R,4R)-4-fluoro-1-[1-[4-(2-hydroxypropan-2-yl)phenyl]cyclohexanecarbonyl]-N-(1H-pyrazolo[4,5-b]pyridin-5-yl)pyrrolidine-2-carboxamide;4-[1-[(2R,4R)-4-fluoro-2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazolo[4,5-b]pyridin-5-yl]carbamoyl]pyrrolidine-1-carbonyl]cyclohexyl]benzoic acid;methyl 4-[1-[(2R,4R)-4-fluoro-2-(1H-pyrazolo[4,5-b]pyridin-5-ylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexyl]benzoate is sourced from PubChem (CID 159276951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).