CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00528083" 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.

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CFAM Mol ID CFAMM00528083
Family CFFBM46561 Nuclear receptor ROR-gamma and Lethal factor ligand NSC211094 family
Superfamily CFSBM4824 Pol polyprotein and Glucagon receptor Binder Superfamily
Class CFCAD281 Class 281
External ID CHEMBL428784 External Source CHEMBL
PubChem CID 308963 Functional Category Bioactive
Molecule Name NSC211094
IUPAC Name 5-[(4-tert-butylphenoxy)carbonylamino]-2-hydroxybenzoic acid
Synonyms MLS000756501;NSC-211094;5-[(4-tert-butylphenoxy)carbonylamino]-2-hydroxybenzoic acid;Compound D14;NCIStruc1_001616;NCIStruc2_001594;SureCN3989897;AC1L7E13;HMS2886P12
InChi InChI=1S/C18H19NO5/c1-18(2,3)11-4-7-13(8-5-11)24-17(23)19-12-6-9-15(20)14(10-12)16(21)22/h4-10,20H,1-3H3,(H,19,23)(H,21,22)
InChiKey QDDQSSZZYNCVHC-UHFFFAOYSA-N
Formula C18H19NO5 Molecular Weight 329.35
Cross Link CHEMBL428784
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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