NBI27914

Ligand id: 3512

Name: NBI27914

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 41.05
Molecular weight 432.04
XLogP 5.2
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-chloro-N-(cyclopropylmethyl)-2-methyl-N-propyl-N'-(2,4,6-trichlorophenyl)pyrimidine-4,6-diamine
Synonyms
NBI 27914 | NBI-27914
Database Links
CAS Registry No. 184241-44-9 (source: Scifinder)
ChEMBL Ligand CHEMBL45281
PubChem CID 176157
Search Google for chemical match using the InChIKey KNADXBVKFAUMCR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KNADXBVKFAUMCR
Search UniChem for chemical match using the InChIKey KNADXBVKFAUMCR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KNADXBVKFAUMCR