RS-136270

Ligand id: 780

Name: RS-136270

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 42.23
Molecular weight 235.04
XLogP 3.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[(3-chlorophenyl)methyl]pyrrole-2-carboxylic acid
Database Links
CAS Registry No. 702670-05-1 (source: Scifinder)
PubChem CID 5071702
Search Google for chemical match using the InChIKey VPTUTBZAHHDMAA-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VPTUTBZAHHDMAA
Search UniChem for chemical match using the InChIKey VPTUTBZAHHDMAA-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VPTUTBZAHHDMAA