CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00113178" in compound.

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CFAM Mol ID CFAMM00113178
Family CFFAD925 Sarcoplasmic/endoplasmic reticulum calcium ATPase inhibitor quinoline derivative Piperaquine Family
Superfamily CFSAD133 Glutamate dehydrogenase, calcium ATPase binding quinoline derivative Chloroquine Piperaquine Superfamily
Class CFCAD131 Class 131
External ID CHEMBL1771542 External Source CHEMBL
PubChem CID 54586452 Functional Category Bioactive
Molecule Name AGN-PC-0A9U51
IUPAC Name 4-pyrrolidin-1-yl-1-[[4-[3-[4-[(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]propyl]phenyl]methyl]pyridin-1-ium;dibromide
Synonyms CHEBI:1243854;4-pyrrolidin-1-yl-1-[[4-[3-[4-[(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)methyl]phenyl]propyl]phenyl]methyl]pyridin-1-ium;dibromide
InChi InChI=1S/C35H42N4.2BrH/c1-2-21-38(20-1)34-16-24-36(25-17-34)28-32-12-8-30(9-13-32)6-5-7-31-10-14-33(15-11-31)29-37-26-18-35(19-27-37)39-22-3-4-23-39;;/h8-19,24-27H,1-7,20-23,28-29H2;2*1H/q+2;;/p-2
Formula C35H42Br2N4 Molecular Weight 678.54
Cross Link CHEMBL1771542

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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