General
Preferred name
BW284C51
Synonyms
P&D ID
PD048017
CAS
402-40-4
Tags
available
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()] ]]
Cell lines
0
Organisms
1
Compound Sets
7
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
DrugMAP
Guide to Pharmacology
Ki Database
External IDs
31
Properties
(calculated by RDKit )
Molecular Weight
406.3
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
12
Ring Count
2
Aromatic Ring Count
2
cLogP
5.33
TPSA
17.07
Fraction CSP3
0.37
Chiral centers
0.0
Largest ring
6.0
QED
0.34
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data