General
Preferred name
PMID20483621C5m
Synonyms
compound 5m [PMID: 20483621] ()
P&D ID
PD046661
CAS
957194-90-0
Tags
drug candidate
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Compound 5m is reported in as an inhibitor of anaplastic lymphoma receptor tyrosine kinase (ALK). (GtoPdb)
Compound Sets
2
DrugMAP
DML6OZR
Guide to Pharmacology
8206
External IDs
10
Properties
(calculated by RDKit )
Molecular Weight
583.23
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
1
Rotatable Bonds
5
Ring Count
6
Aromatic Ring Count
3
cLogP
6.55
TPSA
51.71
Fraction CSP3
0.42
Chiral centers
0.0
Largest ring
6.0
QED
0.37
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data