ICI198615

Ligand id: 3358

Name: ICI198615

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 137
Molecular weight 548.17
XLogP 4.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
cyclopentyl N-[1-({4-[(benzenesulfonyl)carbamoyl]-2-methoxyphenyl}methyl)-1H-indazol-6-yl]carbamate
Synonyms
ICI 198615 | ICI-198615
Database Links
CAS Registry No. 104448-53-5 (source: Scifinder)
ChEMBL Ligand CHEMBL22033
GtoPdb PubChem SID 178100384
PubChem CID 115219
Search Google for chemical match using the InChIKey YRCPIXCRSAKRGM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YRCPIXCRSAKRGM
Search UniChem for chemical match using the InChIKey YRCPIXCRSAKRGM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone YRCPIXCRSAKRGM