General
Preferred name
ISRAPAFANT
Synonyms
P&D ID
PD014809
CAS
117279-73-9
Tags
available
drug candidate
Drug indication
Asthma
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
The INN-assigned compound israpafant is a racemic mixture of two enantiomers. The structure shown here does not specify stereochemistry and represents the mixture.
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
6
ChEMBL Drugs
DrugMAP
DrugMatrix
Guide to Pharmacology
NPC Screening Collection
ReFrame library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
488.18
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
0
Rotatable Bonds
6
Ring Count
5
Aromatic Ring Count
4
cLogP
7.19
TPSA
43.07
Fraction CSP3
0.32
Chiral centers
1.0
Largest ring
7.0
QED
0.29
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data