TCPA

Ligand id: 5590

Name: TCPA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 6
Rotatable bonds 9
Topological polar surface area 191.4
Molecular weight 497.21
XLogP 1.77
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1E)-1-[[6-(cyclopentylamino)-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-2-yl]hydrazinylidene]-3-phenylurea
Synonyms
N6-cyclopentyl-2-(3-phenylaminocarbonyltriazene-1-yl)adenosine
Database Links
ChEMBL Ligand CHEMBL2113457
PubChem CID 10391170
Search Google for chemical match using the InChIKey RZJAODYQRFMAKN-WVSUBDOOSA-N
Search Google for chemicals with the same backbone RZJAODYQRFMAKN
Search UniChem for chemical match using the InChIKey RZJAODYQRFMAKN-WVSUBDOOSA-N
Search UniChem for chemicals with the same backbone RZJAODYQRFMAKN