6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride

C136H167Cl15N34O4S — CID 159431264

About 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride

6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride (PubChem CID 159431264) has the molecular formula C136H167Cl15N34O4S and a molecular weight of 2905.93 g/mol. Its IUPAC name is 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride.

Molecular Properties

• Compound Name: 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride
• PubChem CID: 159431264
• Molecular Formula: C136H167Cl15N34O4S
• Molecular Weight: 2905.93 g/mol
• Exact Mass: 2896.90
• IUPAC Name: 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride
• SMILES: C.C.C.C.C.CC1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1C(N)=O.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1C.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1CN.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1CNS(C)(=O)=O.C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(C3=CCC(N4CCC[C@H]4C(N)=O)[C@@H](C)C3)nc21.Cl.Cl.Cl.Cl.Cl
• InChI: InChI=1S/C27H31Cl2N7O2S.2C26H27Cl2N7O.C26H29Cl2N7.C26H28Cl2N6.5CH4.5ClH/c1-16-11-18(6-9-25(16)35-10-4-5-20(35)14-32-39(3,37)38)24-15-31-26-23(13-30)34-36(27(26)33-24)17(2)21-8-7-19(28)12-22(21)29;2*1-14-10-16(5-8-22(14)34-9-3-4-23(34)25(30)36)21-13-31-24-20(12-29)33-35(26(24)32-21)15(2)18-7-6-17(27)11-19(18)28;1-15-10-17(5-8-24(15)34-9-3-4-19(34)12-29)23-14-31-25-22(13-30)33-35(26(25)32-23)16(2)20-7-6-18(27)11-21(20)28;1-15-11-18(6-9-24(15)33-10-4-5-16(33)2)23-14-30-25-22(13-29)32-34(26(25)31-23)17(3)20-8-7-19(27)12-21(20)28;;;;;;;;;;/h6-8,12,15-17,20,25,32H,4-5,9-11,14H2,1-3H3;2*5-7,11,13-15,22-23H,3-4,8-10H2,1-2H3,(H2,30,36);5-7,11,14-16,19,24H,3-4,8-10,12,29H2,1-2H3;6-8,12,14-17,24H,4-5,9-11H2,1-3H3;5*1H4;5*1H/t16-,17-,20+,25?;14?,15-,22?,23+;14-,15+,22?,23-;15-,16-,19+,24?;15-,16-,17-,24?;;;;;;;;;;/m11011........../s1
• InChIKey: PEYMYTJMYCREJW-XAXWBIIASA-N
• XLogP: 31.09
• TPSA: 511.52 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 35
• Rotatable Bonds: 26
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2905.93
LogP ≤ 5	31.09
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride?

The IUPAC name of 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride (CID 159431264) is 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride.

What is the SMILES notation for 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride?

The canonical SMILES for 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride is C.C.C.C.C.CC1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1C(N)=O.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1C.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1CN.C[C@@H]1CC(c2cnc3c(C#N)nn([C@H](C)c4ccc(Cl)cc4Cl)c3n2)=CCC1N1CCC[C@H]1CNS(C)(=O)=O.C[C@H](c1ccc(Cl)cc1Cl)n1nc(C#N)c2ncc(C3=CCC(N4CCC[C@H]4C(N)=O)[C@@H](C)C3)nc21.Cl.Cl.Cl.Cl.Cl.

What is the InChIKey of 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride?

The InChIKey is PEYMYTJMYCREJW-XAXWBIIASA-N. The full InChI is InChI=1S/C27H31Cl2N7O2S.2C26H27Cl2N7O.C26H29Cl2N7.C26H28Cl2N6.5CH4.5ClH/c1-16-11-18(6-9-25(16)35-10-4-5-20(35)14-32-39(3,37)38)24-15-31-26-23(13-30)34-36(27(26)33-24)17(2)21-8-7-19(28)12-22(21)29;2*1-14-10-16(5-8-22(14)34-9-3-4-23(34)25(30)36)21-13-31-24-20(12-29)33-35(26(24)32-21)15(2)18-7-6-17(27)11-19(18)28;1-15-10-17(5-8-24(15)34-9-3-4-19(34)12-29)23-14-31-25-22(13-30)33-35(26(25)32-23)16(2)20-7-6-18(27)11-21(20)28;1-15-11-18(6-9-24(15)33-10-4-5-16(33)2)23-14-30-25-22(13-29)32-34(26(25)31-23)17(3)20-8-7-19(27)12-21(20)28;;;;;;;;;;/h6-8,12,15-17,20,25,32H,4-5,9-11,14H2,1-3H3;2*5-7,11,13-15,22-23H,3-4,8-10H2,1-2H3,(H2,30,36);5-7,11,14-16,19,24H,3-4,8-10,12,29H2,1-2H3;6-8,12,14-17,24H,4-5,9-11H2,1-3H3;5*1H4;5*1H/t16-,17-,20+,25?;14?,15-,22?,23+;14-,15+,22?,23-;15-,16-,19+,24?;15-,16-,17-,24?;;;;;;;;;;/m11011........../s1.

What are the key properties of 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride?

6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride has a molecular weight of 2905.93 g/mol, XLogP of 31.09, 26 rotatable bonds, 4 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(5R)-4-[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-5-methylcyclohexen-1-yl]-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;(2S)-1-[4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;(2S)-1-[(6S)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidine-2-carboxamide;N-[[(2S)-1-[(6R)-4-[3-cyano-1-[(1R)-1-(2,4-dichlorophenyl)ethyl]pyrazolo[3,4-b]pyrazin-6-yl]-6-methylcyclohex-3-en-1-yl]pyrrolidin-2-yl]methyl]methanesulfonamide;1-[(1R)-1-(2,4-dichlorophenyl)ethyl]-6-[(5R)-5-methyl-4-[(2R)-2-methylpyrrolidin-1-yl]cyclohexen-1-yl]pyrazolo[3,4-b]pyrazine-3-carbonitrile;methane;pentahydrochloride is sourced from PubChem (CID 159431264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).