CFam Chemical Families Database
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You are searching for "CFAMM00450076" in compound.

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CFAM Mol ID CFAMM00450076
Family CFFBM18968 C-C chemokine receptor type 5 ligand 5-[(3aR,6aS)-2-[2-[1-(4,4-difluorocyclohexanecarbonyl)-3-phenylazetidin-3-yl]ethyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]-4,6-dimethylpyridine-2-carbonitrile family
Superfamily CFSBM1359 Cannabinoid receptor 1 and C-C chemokine receptor type 5 Binder Superfamily
Class CFCAD173 Class 173
External ID CHEMBL593042 External Source CHEMBL
PubChem CID 46225532 Functional Category Bioactive
Molecule Name 5-[(3aS,6aR)-2-[2-[1-(3,3-difluorocyclobutanecarbonyl)-3-phenylazetidin-3-yl]ethyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]-4,6-dimethylpyridine-2-carbonitrile
IUPAC Name 5-[(3aS,6aR)-2-[2-[1-(3,3-difluorocyclobutanecarbonyl)-3-phenylazetidin-3-yl]ethyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]-4,6-dimethylpyridine-2-carbonitrile
Synonyms CHEBI:691550
InChi InChI=1S/C31H35F2N5O2/c1-20-10-26(13-34)35-21(2)27(20)29(40)37-16-23-14-36(15-24(23)17-37)9-8-30(25-6-4-3-5-7-25)18-38(19-30)28(39)22-11-31(32,33)12-22/h3-7,10,22-24H,8-9,11-12,14-19H2,1-2H3/t23-,24+
Formula C31H35F2N5O2 Molecular Weight 547.64
Cross Link CHEMBL593042

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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