CFam Chemical Families Database
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You are searching for "CFAMM00161623" in compound.

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CFAM Mol ID CFAMM00161623
Family CFFCD510 Tumor necrosis factor Inhibitor Tgaac-94 Family
Superfamily CFSCD467 Tumor necrosis factor Inhibitor Tgaac-94 Superfamily
Class CFCCD332 Class 1145
External ID CHEMBL1256716 External Source CHEMBL
PubChem CID 167980 Functional Category Bioactive
Molecule Name Urapidil hydrochloride
IUPAC Name 6-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-1,3-dimethylpyrimidine-2,4-dione;hydrochloride
Synonyms 64887-14-5;Urapidil HCl;HS-0064;NCGC00094502-01;Ebrantil (TN);DSSTox_CID_25812;DSSTox_RID_81149;DSSTox_GSID_45812;6-({3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}amino)-1,3-dimethylpyrimidine-2,4(1h,3h)-dione hydrochloride(1:1);SMR000058525
InChi InChI=1S/C20H29N5O3.ClH/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3;/h4-5,7-8,15,21H,6,9-14H2,1-3H3;1H
InChiKey KTMLZVUAXJERAT-UHFFFAOYSA-N
Formula C20H30ClN5O3 Molecular Weight 423.94
Cross Link CHEMBL1256716
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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