IQM-97423

Ligand id: 876

Name: IQM-97423

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 11
Topological polar surface area 126.64
Molecular weight 558.3
XLogP 4.61
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S)-N-[(4aS,5R)-1,3-dioxo-2-(phenylmethyl)-4,4a,5,6,7,8-hexahydropyrido[2,1-f]pyrimidin-5-yl]-2-(tert-butylcarbamoylamino)-3-(1H-indol-3-yl)propanamide
Synonyms
IQM-97,423
Database Links
ChEMBL Ligand CHEMBL2112828
PubChem CID 11757476
Search Google for chemical match using the InChIKey JQMXXJDAKTTXOB-ZNZIZOMTSA-N
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Search UniChem for chemical match using the InChIKey JQMXXJDAKTTXOB-ZNZIZOMTSA-N
Search UniChem for chemicals with the same backbone JQMXXJDAKTTXOB