NIP

Ligand id: 546

Name: NIP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 41.49
Molecular weight 209.14
XLogP 2.39
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(phenoxy)-3-(propan-2-ylamino)propan-2-ol
Synonyms
N-isopropyl-phenoxypropanolamine
Database Links
BindingDB Ligand 50169785
CAS Registry No. 7695-63-8 (source: Scifinder)
ChEMBL Ligand CHEMBL7154
PubChem CID 3123920
Search Google for chemical match using the InChIKey ONXLHKFGTDDVLQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ONXLHKFGTDDVLQ
Search UniChem for chemical match using the InChIKey ONXLHKFGTDDVLQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ONXLHKFGTDDVLQ