4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid

C129H121BCl3F16N15O13 — CID 159566288

About 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid

4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid (PubChem CID 159566288) has the molecular formula C129H121BCl3F16N15O13 and a molecular weight of 2510.62 g/mol. Its IUPAC name is 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid.

Molecular Properties

• Compound Name: 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid
• PubChem CID: 159566288
• Molecular Formula: C129H121BCl3F16N15O13
• Molecular Weight: 2510.62 g/mol
• Exact Mass: 2507.82
• IUPAC Name: 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid
• SMILES: CC(C)(O)C#Cc1ccc(B(O)O)c([C@@H](CC(=O)OC(C)(C)C)Cc2cc(F)cc(F)c2)n1.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](CC(=O)Cn3nc(C(F)F)c4c3C(F)(F)[C@@H]3C[C@H]43)Cc3cc(F)cc(F)c3)c21.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](CC(=O)OC(C)(C)C)Cc3cc(F)cc(F)c3)c21.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](N)Cc3cc(F)cc(F)c3)c21.O=C(O)Cn1nc(C(F)F)c2c1C(F)(F)[C@@H]1C[C@H]21
• InChI: InChI=1S/C37H30ClF6N5O2.C32H32ClF2N3O3.C26H23ClF2N4O.C24H28BF2NO5.C10H8F4N2O2/c1-36(2,51)9-8-22-4-5-24(25-6-7-29(38)27-16-45-48(3)33(25)27)31(46-22)19(10-18-11-20(39)14-21(40)12-18)13-23(50)17-49-34-30(32(47-49)35(41)42)26-15-28(26)37(34,43)44;1-31(2,3)41-28(39)16-20(13-19-14-21(34)17-22(35)15-19)29-24(8-7-23(37-29)11-12-32(4,5)40)25-9-10-27(33)26-18-36-38(6)30(25)26;1-26(2,34)9-8-18-4-5-19(20-6-7-22(27)21-14-31-33(3)25(20)21)24(32-18)23(30)12-15-10-16(28)13-17(29)11-15;1-23(2,3)33-21(29)13-16(10-15-11-17(26)14-18(27)12-15)22-20(25(31)32)7-6-19(28-22)8-9-24(4,5)30;11-9(12)7-6-3-1-4(3)10(13,14)8(6)16(15-7)2-5(17)18/h4-7,11-12,14,16,19,26,28,35,51H,10,13,15,17H2,1-3H3;7-10,14-15,17-18,20,40H,13,16H2,1-6H3;4-7,10-11,13-14,23,34H,12,30H2,1-3H3;6-7,11-12,14,16,30-32H,10,13H2,1-5H3;3-4,9H,1-2H2,(H,17,18)/t19-,26+,28-;20-;23-;16-;3-,4+/m11010/s1
• InChIKey: MHFWXPVTLGXWRK-TZGNTNNUSA-N
• XLogP: 24.03
• TPSA: 395.03 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 27
• Rotatable Bonds: 28
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2510.62
LogP ≤ 5	24.03
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid?

The IUPAC name of 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid (CID 159566288) is 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid.

What is the SMILES notation for 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid?

The canonical SMILES for 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid is CC(C)(O)C#Cc1ccc(B(O)O)c([C@@H](CC(=O)OC(C)(C)C)Cc2cc(F)cc(F)c2)n1.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](CC(=O)Cn3nc(C(F)F)c4c3C(F)(F)[C@@H]3C[C@H]43)Cc3cc(F)cc(F)c3)c21.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](CC(=O)OC(C)(C)C)Cc3cc(F)cc(F)c3)c21.Cn1ncc2c(Cl)ccc(-c3ccc(C#CC(C)(C)O)nc3[C@@H](N)Cc3cc(F)cc(F)c3)c21.O=C(O)Cn1nc(C(F)F)c2c1C(F)(F)[C@@H]1C[C@H]21.

What is the InChIKey of 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid?

The InChIKey is MHFWXPVTLGXWRK-TZGNTNNUSA-N. The full InChI is InChI=1S/C37H30ClF6N5O2.C32H32ClF2N3O3.C26H23ClF2N4O.C24H28BF2NO5.C10H8F4N2O2/c1-36(2,51)9-8-22-4-5-24(25-6-7-29(38)27-16-45-48(3)33(25)27)31(46-22)19(10-18-11-20(39)14-21(40)12-18)13-23(50)17-49-34-30(32(47-49)35(41)42)26-15-28(26)37(34,43)44;1-31(2,3)41-28(39)16-20(13-19-14-21(34)17-22(35)15-19)29-24(8-7-23(37-29)11-12-32(4,5)40)25-9-10-27(33)26-18-36-38(6)30(25)26;1-26(2,34)9-8-18-4-5-19(20-6-7-22(27)21-14-31-33(3)25(20)21)24(32-18)23(30)12-15-10-16(28)13-17(29)11-15;1-23(2,3)33-21(29)13-16(10-15-11-17(26)14-18(27)12-15)22-20(25(31)32)7-6-19(28-22)8-9-24(4,5)30;11-9(12)7-6-3-1-4(3)10(13,14)8(6)16(15-7)2-5(17)18/h4-7,11-12,14,16,19,26,28,35,51H,10,13,15,17H2,1-3H3;7-10,14-15,17-18,20,40H,13,16H2,1-6H3;4-7,10-11,13-14,23,34H,12,30H2,1-3H3;6-7,11-12,14,16,30-32H,10,13H2,1-5H3;3-4,9H,1-2H2,(H,17,18)/t19-,26+,28-;20-;23-;16-;3-,4+/m11010/s1.

What are the key properties of 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid?

4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid has a molecular weight of 2510.62 g/mol, XLogP of 24.03, 28 rotatable bonds, 8 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[6-[(1S)-1-amino-2-(3,5-difluorophenyl)ethyl]-5-(4-chloro-1-methylindazol-7-yl)-2-pyridinyl]-2-methylbut-3-yn-2-ol;tert-butyl (3R)-3-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-4-(3,5-difluorophenyl)butanoate;(4R)-4-[3-(4-chloro-1-methylindazol-7-yl)-6-(3-hydroxy-3-methylbut-1-ynyl)-2-pyridinyl]-1-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]-5-(3,5-difluorophenyl)pentan-2-one;2-[(2S,4R)-9-(difluoromethyl)-5,5-difluoro-7,8-diazatricyclo[4.3.0.02,4]nona-1(6),8-dien-7-yl]acetic acid;[2-[(2R)-1-(3,5-difluorophenyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]-6-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinyl]boronic acid is sourced from PubChem (CID 159566288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).