CFam Chemical Families Database
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You are searching for "CFAMM00333489" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00333489
Family CFFBM2386 D(2) dopamine receptor and 5-hydroxytryptamine receptor 2C ligand Lu 22-135 family
Superfamily CFSBM1321 D(2) dopamine receptor and 5-hydroxytryptamine receptor 6 Binder Superfamily
Class CFCID60 Class 1410
External ID 181779 External Source PubChem
PubChem CID 181779 Functional Category Patent Compound
Molecule Name AC1L49NQ
IUPAC Name 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one
Synonyms 1-[1-(3,5-dimethylphenyl)-5-methyl-3-(4-nitrophenyl)pyrrol-2-yl]propan-2-one;66144-25-0
InChi InChI=1S/C22H22N2O3/c1-14-9-15(2)11-20(10-14)23-16(3)12-21(22(23)13-17(4)25)18-5-7-19(8-6-18)24(26)27/h5-12H,13H2,1-4H3
InChiKey JVVKCOSMLOVIDI-UHFFFAOYSA-N
Formula C22H22N2O3 Molecular Weight 362.42
Cross Link
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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