compound 29 [PMID: 17064898]

Ligand id: 6208

Name: compound 29 [PMID: 17064898]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 78.35
Molecular weight 318.21
XLogP 1.38
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-cyclohexyl-5-[4-(hydroxymethyl)piperidin-1-yl]pyrazine-2-carboxamide
Database Links
PubChem CID 73755189
Search Google for chemical match using the InChIKey JKQOZEOZKKMWQL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JKQOZEOZKKMWQL
Search UniChem for chemical match using the InChIKey JKQOZEOZKKMWQL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JKQOZEOZKKMWQL