CFam Chemical Families Database
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You are searching for "CFAMM00294404" 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 CFAMM00294404
Family CFFID3600 Alpha-1A adrenergic receptor and Alpha-1B adrenergic receptor Ligand Siramesine Family
Superfamily CFSID2438 D(2) dopamine receptor and D(1B) dopamine receptor Binder Superfamily
Class CFCID1398 Class 2748
External ID DNC012651 External Source TTD
PubChem CID 9829526 Functional Category Investigative Drug
Molecule Name Siramesine
IUPAC Name 1'-[4-[1-(4-fluorophenyl)indol-3-yl]butyl]spiro[1H-2-benzofuran-3,4'-piperidine]
Synonyms 147817-50-3;Siramesine [INN];Lu 28-179;Lu-28-179;UNII-3IX8CWR24V;SureCN2090079;CHEMBL61479;QCR-66;AGN-PC-0074K5;CHEBI:196117
InChi InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,16-20,22H2
InChiKey XWAONOGAGZNUSF-UHFFFAOYSA-N
Formula C30H31FN2O Molecular Weight 454.58
Cross Link CHEMBL61479
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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