[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid

C100H141Cl5F6N31O46P5 — CID 164976716

About [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid

[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid (PubChem CID 164976716) has the molecular formula C100H141Cl5F6N31O46P5 and a molecular weight of 2959.52 g/mol. Its IUPAC name is [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid.

Molecular Properties

• Compound Name: [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid
• PubChem CID: 164976716
• Molecular Formula: C100H141Cl5F6N31O46P5
• Molecular Weight: 2959.52 g/mol
• Exact Mass: 2955.67
• IUPAC Name: [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid
• SMILES: COCC(CC(=O)O)(OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O)P(=O)(O)O.C[C@@H]1CCC[C@@H]1Nc1nc(Cl)nc2c1cnn2[C@@H]1O[C@H](COC(CO)(Cc2nn[nH]n2)P(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)[C@@](CO)(COCC(F)(F)F)OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O.O=P(O)(O)[C@](CO)(COCC(F)(F)F)OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O.O=c1[nH]c(CC(CO)(OC[C@H]2O[C@@H](n3ncc4c(NC5CCCC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)P(=O)(O)O)no1
• InChI: InChI=1S/2C20H28ClF3N5O9P.C20H29ClN9O8P.C20H27ClN7O10P.C20H29ClN5O10P/c2*21-18-27-15(26-10-3-1-2-4-10)11-5-25-29(16(11)28-18)17-14(32)13(31)12(38-17)6-37-19(7-30,39(33,34)35)8-36-9-20(22,23)24;1-9-3-2-4-11(9)23-16-10-6-22-30(17(10)25-19(21)24-16)18-15(33)14(32)12(38-18)7-37-20(8-31,39(34,35)36)5-13-26-28-29-27-13;21-18-25-15(23-9-3-1-2-4-9)10-6-22-28(16(10)26-18)17-14(31)13(30)11(37-17)7-36-20(8-29,39(33,34)35)5-12-24-19(32)38-27-12;1-34-9-20(6-13(27)28,37(31,32)33)35-8-12-14(29)15(30)18(36-12)26-17-11(7-22-26)16(24-19(21)25-17)23-10-4-2-3-5-10/h2*5,10,12-14,17,30-32H,1-4,6-9H2,(H,26,27,28)(H2,33,34,35);6,9,11-12,14-15,18,31-33H,2-5,7-8H2,1H3,(H,23,24,25)(H2,34,35,36)(H,26,27,28,29);6,9,11,13-14,17,29-31H,1-5,7-8H2,(H,23,25,26)(H,24,27,32)(H2,33,34,35);7,10,12,14-15,18,29-30H,2-6,8-9H2,1H3,(H,27,28)(H,23,24,25)(H2,31,32,33)/t12-,13-,14-,17-,19+;12-,13-,14-,17-,19-;9-,11+,12-,14-,15-,18-,20?;11-,13-,14-,17-,20?;12-,14-,15-,18-,20?/m11111/s1
• InChIKey: DWWRJBHJUSPQQU-WNPKEDOWSA-N
• XLogP: 0.89
• TPSA: 1119.66 Ų
• H-Bond Donors: 32
• H-Bond Acceptors: 64
• Rotatable Bonds: 53
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2959.52
LogP ≤ 5	0.89
H-Bond Donors ≤ 5	32
H-Bond Acceptors ≤ 10	64

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid?

The IUPAC name of [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid (CID 164976716) is [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid.

What is the SMILES notation for [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid?

The canonical SMILES for [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid is COCC(CC(=O)O)(OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O)P(=O)(O)O.C[C@@H]1CCC[C@@H]1Nc1nc(Cl)nc2c1cnn2[C@@H]1O[C@H](COC(CO)(Cc2nn[nH]n2)P(=O)(O)O)[C@@H](O)[C@H]1O.O=P(O)(O)[C@@](CO)(COCC(F)(F)F)OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O.O=P(O)(O)[C@](CO)(COCC(F)(F)F)OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O.O=c1[nH]c(CC(CO)(OC[C@H]2O[C@@H](n3ncc4c(NC5CCCC5)nc(Cl)nc43)[C@H](O)[C@@H]2O)P(=O)(O)O)no1.

What is the InChIKey of [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid?

The InChIKey is DWWRJBHJUSPQQU-WNPKEDOWSA-N. The full InChI is InChI=1S/2C20H28ClF3N5O9P.C20H29ClN9O8P.C20H27ClN7O10P.C20H29ClN5O10P/c2*21-18-27-15(26-10-3-1-2-4-10)11-5-25-29(16(11)28-18)17-14(32)13(31)12(38-17)6-37-19(7-30,39(33,34)35)8-36-9-20(22,23)24;1-9-3-2-4-11(9)23-16-10-6-22-30(17(10)25-19(21)24-16)18-15(33)14(32)12(38-18)7-37-20(8-31,39(34,35)36)5-13-26-28-29-27-13;21-18-25-15(23-9-3-1-2-4-9)10-6-22-28(16(10)26-18)17-14(31)13(30)11(37-17)7-36-20(8-29,39(33,34)35)5-12-24-19(32)38-27-12;1-34-9-20(6-13(27)28,37(31,32)33)35-8-12-14(29)15(30)18(36-12)26-17-11(7-22-26)16(24-19(21)25-17)23-10-4-2-3-5-10/h2*5,10,12-14,17,30-32H,1-4,6-9H2,(H,26,27,28)(H2,33,34,35);6,9,11-12,14-15,18,31-33H,2-5,7-8H2,1H3,(H,23,24,25)(H2,34,35,36)(H,26,27,28,29);6,9,11,13-14,17,29-31H,1-5,7-8H2,(H,23,25,26)(H,24,27,32)(H2,33,34,35);7,10,12,14-15,18,29-30H,2-6,8-9H2,1H3,(H,27,28)(H,23,24,25)(H2,31,32,33)/t12-,13-,14-,17-,19+;12-,13-,14-,17-,19-;9-,11+,12-,14-,15-,18-,20?;11-,13-,14-,17-,20?;12-,14-,15-,18-,20?/m11111/s1.

What are the key properties of [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid?

[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid has a molecular weight of 2959.52 g/mol, XLogP of 0.89, 53 rotatable bonds, 32 hydrogen bond donors, and 64 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(5-oxo-4H-1,2,4-oxadiazol-3-yl)propan-2-yl]phosphonic acid;[(2R)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;[(2S)-2-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2,2,2-trifluoroethoxy)propan-2-yl]phosphonic acid;3-[[(2R,3S,4R,5R)-5-[6-chloro-4-(cyclopentylamino)pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-4-methoxy-3-phosphonobutanoic acid;[2-[[(2R,3S,4R,5R)-5-[6-chloro-4-[[(1S,2R)-2-methylcyclopentyl]amino]pyrazolo[3,4-d]pyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methoxy]-1-hydroxy-3-(2H-tetrazol-5-yl)propan-2-yl]phosphonic acid is sourced from PubChem (CID 164976716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).