CFam Chemical Families Database
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You are searching for "CFAMM00245460" in compound.

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CFAM Mol ID CFAMM00245460
Family CFFID1650 Adenosine receptor A1 and Adenosine receptor A2a Ligand GW-328267 Family
Superfamily CFSID1282 Adenosine receptor A1 and Adenosine receptor A2a Binder Superfamily 4
Class CFCAD652 Class 652
External ID CHEMBL601731 External Source CHEMBL
PubChem CID 46230244 Functional Category Bioactive
Molecule Name (1R,2S,3R,5S)-3-[6-(2,2-diphenylethylamino)-2-[2-(1-ethylimidazol-4-yl)ethylamino]purin-9-yl]-5-(4-ethylpyrazol-1-yl)cyclopentane-1,2-diol
IUPAC Name (1R,2S,3R,5S)-3-[6-(2,2-diphenylethylamino)-2-[2-(1-ethylimidazol-4-yl)ethylamino]purin-9-yl]-5-(4-ethylpyrazol-1-yl)cyclopentane-1,2-diol
Synonyms CHEBI:699305
InChi InChI=1S/C36H42N10O2/c1-3-24-18-41-46(20-24)30-17-29(32(47)33(30)48)45-23-40-31-34(38-19-28(25-11-7-5-8-12-25)26-13-9-6-10-14-26)42-36(43-35(31)45)37-16-15-27-21-44(4-2)22-39-27/h5-14,18,20-23,28-30,32-33,47-48H,3-4,15-17,19H2,1-2H3,(H2,37,38,42,43)/t29-,30+,32+,33-/m1/s1
Formula C36H42N10O2 Molecular Weight 646.78
Cross Link CHEMBL601731

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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