compound 15 [PMID: 18178086]

Ligand id: 6993

Name: compound 15 [PMID: 18178086]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 80.91
Molecular weight 495.11
XLogP 4.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[(2S)-1-[4-[(3,4-dichlorophenyl)-dimethylidene-$l^{6}-sulfanyl]piperazin-1-yl]propan-2-yl]-7-methylthieno[3,2-d]pyrimidin-4-amine
Database Links
PubChem CID 73755255
Search Google for chemical match using the InChIKey WBVRCGUUZYPAGR-INIZCTEOSA-N
Search Google for chemicals with the same backbone WBVRCGUUZYPAGR
Search UniChem for chemical match using the InChIKey WBVRCGUUZYPAGR-INIZCTEOSA-N
Search UniChem for chemicals with the same backbone WBVRCGUUZYPAGR