1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine

C95H93N37O2S2 — CID 161310951

IUPAC1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine
SMILESCC(C)n1cnc2c(NCc3nc4ccccc4[nH]3)nc(Nc3ccncn3)nc21.O=C(CC1CC1)N1CCN(c2nc(NCc3nc4ccccc4[nH]3)c3ncn(-c4ccsc4)c3n2)CC1.c1ccc(-n2cnc3c(NCc4nc5ccccc5[nH]4)nc(N4CCOCC4)nc32)cc1.c1ccc(N2CCN(c3nc(NCc4nc5ccccc5[nH]4)c4ncn(-c5ccsc5)c4n3)CC2)nc1
InChIInChI=1S/C26H24N10S.C26H27N9OS.C23H22N8O.C20H20N10/c1-2-6-20-19(5-1)30-21(31-20)15-28-24-23-25(36(17-29-23)18-8-14-37-16-18)33-26(32-24)35-12-10-34(11-13-35)22-7-3-4-9-27-22;36-22(13-17-5-6-17)33-8-10-34(11-9-33)26-31-24(27-14-21-29-19-3-1-2-4-20(19)30-21)23-25(32-26)35(16-28-23)18-7-12-37-15-18;1-2-6-16(7-3-1)31-15-25-20-21(24-14-19-26-17-8-4-5-9-18(17)27-19)28-23(29-22(20)31)30-10-12-32-13-11-30;1-12(2)30-11-24-17-18(22-9-16-25-13-5-3-4-6-14(13)26-16)28-20(29-19(17)30)27-15-7-8-21-10-23-15/h1-9,14,16-17H,10-13,15H2,(H,30,31)(H,28,32,33);1-4,7,12,15-17H,5-6,8-11,13-14H2,(H,29,30)(H,27,31,32);1-9,15H,10-14H2,(H,26,27)(H,24,28,29);3-8,10-12H,9H2,1-2H3,(H,25,26)(H2,21,22,23,27,28,29)
InChIKeyVIWMWORVGMEZIM-UHFFFAOYSA-N
MW1849.18 g/mol
LogP14.47
Rot. Bonds24

About 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine

1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine (PubChem CID 161310951) has the molecular formula C95H93N37O2S2 and a molecular weight of 1849.18 g/mol. Its IUPAC name is 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine.

Molecular Properties

Compound Name1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine
PubChem CID161310951
Molecular FormulaC95H93N37O2S2
Molecular Weight1849.18 g/mol
Exact Mass1847.78
IUPAC Name1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine
SMILESCC(C)n1cnc2c(NCc3nc4ccccc4[nH]3)nc(Nc3ccncn3)nc21.O=C(CC1CC1)N1CCN(c2nc(NCc3nc4ccccc4[nH]3)c3ncn(-c4ccsc4)c3n2)CC1.c1ccc(-n2cnc3c(NCc4nc5ccccc5[nH]4)nc(N4CCOCC4)nc32)cc1.c1ccc(N2CCN(c3nc(NCc4nc5ccccc5[nH]4)c4ncn(-c5ccsc5)c4n3)CC2)nc1
InChIInChI=1S/C26H24N10S.C26H27N9OS.C23H22N8O.C20H20N10/c1-2-6-20-19(5-1)30-21(31-20)15-28-24-23-25(36(17-29-23)18-8-14-37-16-18)33-26(32-24)35-12-10-34(11-13-35)22-7-3-4-9-27-22;36-22(13-17-5-6-17)33-8-10-34(11-9-33)26-31-24(27-14-21-29-19-3-1-2-4-20(19)30-21)23-25(32-26)35(16-28-23)18-7-12-37-15-18;1-2-6-16(7-3-1)31-15-25-20-21(24-14-19-26-17-8-4-5-9-18(17)27-19)28-23(29-22(20)31)30-10-12-32-13-11-30;1-12(2)30-11-24-17-18(22-9-16-25-13-5-3-4-6-14(13)26-16)28-20(29-19(17)30)27-15-7-8-21-10-23-15/h1-9,14,16-17H,10-13,15H2,(H,30,31)(H,28,32,33);1-4,7,12,15-17H,5-6,8-11,13-14H2,(H,29,30)(H,27,31,32);1-9,15H,10-14H2,(H,26,27)(H,24,28,29);3-8,10-12H,9H2,1-2H3,(H,25,26)(H2,21,22,23,27,28,29)
InChIKeyVIWMWORVGMEZIM-UHFFFAOYSA-N
XLogP14.47
TPSA430.44 Ų
H-Bond Donors9
H-Bond Acceptors36
Rotatable Bonds24
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001849.18
LogP ≤ 514.47
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1036

Analyze 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine with MolForge

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Related Compounds

6-N-(1H-benzimidazol-2-ylmethyl)-2-N-pyrazin-2-yl-9-thiophen-3-ylpurine-2,6-diamine;N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-2-morpholin-4-yl-9-thiophen-3-ylpurin-6-amine;2-morpholin-4-yl-9-thiophen-3-yl-N-[[4-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]purin-6-amine;2-morpholin-4-yl-9-thiophen-3-yl-N-[[6-(trifluoromethyl)-1H-benzimidazol-2-yl]methyl]purin-6-amine
CID 157406004
4-[9-methyl-8-[(4-morpholin-4-ylpiperidin-1-yl)methyl]-2-(1H-pyrrolo[2,3-c]pyridin-4-yl)purin-6-yl]morpholine;4-[6-(morpholin-4-ylmethyl)-2-(1H-pyrrolo[3,2-c]pyridin-4-yl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 87577839
4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylcyclohexane-1-carboxamide;4-[8-amino-1-[7-(1,3-thiazol-2-yl)-1H-indol-2-yl]imidazo[1,5-a]pyrazin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;N-[[4-[8-amino-1-(7-thiophen-2-yl-1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methyl]acetamide
CID 91131584
6-[6-[4-[2-[(2S)-2-[[6-[6-(2,6-dimethylmorpholin-4-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-5-oxo-4H-thieno[3,2-b]pyridin-7-yl]amino]-2-pyrimidin-2-ylethoxy]ethyl]piperazin-1-yl]-3H-imidazo[4,5-c]pyridin-2-yl]-7-[[(1S)-1-pyrimidin-2-ylethyl]amino]-4H-thieno[3,2-b]pyridin-5-one
CID 154966515
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;1-(2-fluoroethyl)-1-methyl-4-propan-2-ylpiperazin-1-ium;3-methylbutan-2-imine;2-methylidene-4-propan-2-ylimidazolidine;4-methyl-2-propan-2-ylmorpholine;4-methyl-N'-propan-2-ylpiperazine-1-carboximidamide;2-(2-methylpropyl)pyrimidine;N-propan-2-yl-1H-benzimidazol-2-amine;N'-propan-2-ylethanimidamide;bis(N-propan-2-yl-1H-imidazol-2-amine);1-propan-2-ylpiperazine;1-(4-propan-2-ylpiperazin-1-yl)ethanimine;N-propan-2-yl-1,3-thiazol-2-amine;propan-2-ylurea
CID 157228969
1-cyclopropyl-3-[4-[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]sulfanylphenyl]urea;1,1-diethyl-3-[4-[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]sulfanylphenyl]urea;N-[4-[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]sulfanylphenyl]morpholine-4-carboxamide;N-[4-[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]sulfanylphenyl]piperazine-1-carboxamide;N-[4-[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]sulfanylphenyl]piperidine-3-carboxamide
CID 157259790
N-(1H-benzimidazol-2-ylmethyl)-2-(4-methylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine;N-(1H-benzimidazol-2-ylmethyl)-2-piperazin-1-yl-9-thiophen-3-ylpurin-6-amine;N-(1H-benzimidazol-2-ylmethyl)-2-piperidin-1-yl-9-thiophen-3-ylpurin-6-amine;N-(1H-benzimidazol-2-ylmethyl)-2-thiomorpholin-4-yl-9-thiophen-3-ylpurin-6-amine
CID 157597129
5-benzyl-2-methyl-N-(pyridin-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;5-benzyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(2-morpholin-4-ylethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(2-pyrrol-1-ylethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(thiophen-2-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine;N-butyl-2-methyl-5-(thiophen-3-ylmethyl)pyrrolo[3,2-d]pyrimidin-4-amine
CID 158241341
(5R)-1-[2-[[(1S)-1-[4-[4-(2-oxobut-3-enyl)anilino]phenyl]ethyl]amino]thieno[3,2-d]pyrimidin-4-yl]-5-propan-2-ylpyrrolidin-2-one;(5R)-1-[2-[[(1S)-1-[4-[[5-(2-oxobut-3-enyl)-2-pyridinyl]amino]phenyl]ethyl]amino]thieno[3,2-d]pyrimidin-4-yl]-5-propan-2-ylpyrrolidin-2-one;(5R)-5-propan-2-yl-1-[2-[[(1S)-1-[4-[(4-prop-2-enoylpiperazin-1-yl)methyl]phenyl]ethyl]amino]-5H-pyrrolo[3,2-d]pyrimidin-4-yl]pyrrolidin-2-one;bis((5R)-5-propan-2-yl-1-[2-[[(1S)-1-[4-[(4-prop-2-enoylpiperazin-1-yl)methyl]phenyl]ethyl]amino]thieno[3,2-d]pyrimidin-4-yl]pyrrolidin-2-one)
CID 158334804
[3-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpurin-9-yl]pyrrolidin-1-yl]-(5-methylthiophen-2-yl)methanone;[3-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpurin-9-yl]pyrrolidin-1-yl]-phenylmethanone;5-[9-butan-2-yl-2-(3-methylmorpholin-4-yl)purin-6-yl]pyrimidin-2-amine;5-(2-morpholin-4-yl-7H-purin-6-yl)pyrimidin-2-amine
CID 158343329
N-(1H-benzimidazol-2-ylmethyl)-2-chloro-9-thiophen-3-ylpurin-6-amine;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-thiophen-3-ylpurin-6-amine;2,6-dichloro-9-thiophen-3-ylpurine;3H-indol-2-ylmethanamine;morpholine
CID 158635330
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;2-methylidene-4-propan-2-ylimidazolidine;2-methylpropanimidamide;4-methyl-2-propan-2-ylmorpholine;4-methyl-N'-propan-2-ylpiperazine-1-carboximidamide;1-methyl-4-propan-2-yl-1-propylpiperazin-1-ium;2-(2-methylpropyl)pyrimidine;N-propan-2-ylacetamide;N-propan-2-yl-1H-benzimidazol-2-amine;N'-propan-2-ylethanimidamide;bis(N-propan-2-yl-1H-imidazol-2-amine);4-propan-2-ylpiperazine-1-carboximidamide;1-propan-2-ylpiperidine;N-propan-2-yl-1,3-thiazol-2-amine
CID 158816838

Frequently Asked Questions

What is the IUPAC name of 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine?
The IUPAC name of 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine (CID 161310951) is 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine.
What is the SMILES notation for 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine?
The canonical SMILES for 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine is CC(C)n1cnc2c(NCc3nc4ccccc4[nH]3)nc(Nc3ccncn3)nc21.O=C(CC1CC1)N1CCN(c2nc(NCc3nc4ccccc4[nH]3)c3ncn(-c4ccsc4)c3n2)CC1.c1ccc(-n2cnc3c(NCc4nc5ccccc5[nH]4)nc(N4CCOCC4)nc32)cc1.c1ccc(N2CCN(c3nc(NCc4nc5ccccc5[nH]4)c4ncn(-c5ccsc5)c4n3)CC2)nc1.
What is the InChIKey of 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine?
The InChIKey is VIWMWORVGMEZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N10S.C26H27N9OS.C23H22N8O.C20H20N10/c1-2-6-20-19(5-1)30-21(31-20)15-28-24-23-25(36(17-29-23)18-8-14-37-16-18)33-26(32-24)35-12-10-34(11-13-35)22-7-3-4-9-27-22;36-22(13-17-5-6-17)33-8-10-34(11-9-33)26-31-24(27-14-21-29-19-3-1-2-4-20(19)30-21)23-25(32-26)35(16-28-23)18-7-12-37-15-18;1-2-6-16(7-3-1)31-15-25-20-21(24-14-19-26-17-8-4-5-9-18(17)27-19)28-23(29-22(20)31)30-10-12-32-13-11-30;1-12(2)30-11-24-17-18(22-9-16-25-13-5-3-4-6-14(13)26-16)28-20(29-19(17)30)27-15-7-8-21-10-23-15/h1-9,14,16-17H,10-13,15H2,(H,30,31)(H,28,32,33);1-4,7,12,15-17H,5-6,8-11,13-14H2,(H,29,30)(H,27,31,32);1-9,15H,10-14H2,(H,26,27)(H,24,28,29);3-8,10-12H,9H2,1-2H3,(H,25,26)(H2,21,22,23,27,28,29).
What are the key properties of 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine?
1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine has a molecular weight of 1849.18 g/mol, XLogP of 14.47, 24 rotatable bonds, 9 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[6-(1H-benzimidazol-2-ylmethylamino)-9-thiophen-3-ylpurin-2-yl]piperazin-1-yl]-2-cyclopropylethanone;N-(1H-benzimidazol-2-ylmethyl)-2-morpholin-4-yl-9-phenylpurin-6-amine;6-N-(1H-benzimidazol-2-ylmethyl)-9-propan-2-yl-2-N-pyrimidin-4-ylpurine-2,6-diamine;N-(1H-benzimidazol-2-ylmethyl)-2-(4-pyridin-2-ylpiperazin-1-yl)-9-thiophen-3-ylpurin-6-amine is sourced from PubChem (CID 161310951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).