CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00058526" in compound.

Total 1 results found.

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

Search Results

CFAM Mol ID CFAMM00058526
Family CFFAD418 Alpha-1B adrenergic receptor Ligand Lisdexamfetamine Family
Superfamily CFSAD364 Alpha-1B adrenergic receptor Ligand Lisdexamfetamine Superfamily
Class CFCAD342 Class 342
External ID ZINC02116126 External Source ZINC
PubChem CID 1770836 Functional Category Natural Product
Molecule Name AC1LXDOF
IUPAC Name [3-oxo-3-[[(2R)-1-phenylpropan-2-yl]amino]propyl]-[(2S)-1-phenylpropan-2-yl]azanium
Synonyms ZINC02116126;[3-oxo-3-[[(2R)-1-phenylpropan-2-yl]amino]propyl]-[(2S)-1-phenylpropan-2-yl]azanium
InChi InChI=1S/C21H28N2O/c1-17(15-19-9-5-3-6-10-19)22-14-13-21(24)23-18(2)16-20-11-7-4-8-12-20/h3-12,17-18,22H,13-16H2,1-2H3,(H,23,24)/p+1/t17-,18+/m0/s1
InChiKey QYOZODNWEZVAND-ZWKOTPCHSA-O
Formula C21H29N2O+ Molecular Weight 325.47
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
 

 

70843 visits since 2014 .........

 



Dr. Chen Yuzong

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


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00058526'),None, txtsearch, CFAMM00058526|