General
Preferred name
BMS614
Synonyms
BMS-195614 ()
BMS 195614 ()
P&D ID
PD003651
CAS
182135-66-6
Tags
available
drug candidate
Drug indication
Discovery agent
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
antagonist of retinoic acid receptors
(Informer Set)
DESCRIPTION
Selective Rev-Erbalpha agonist
(Tocris Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
5
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
12
Properties
(calculated by RDKit )
Molecular Weight
448.18
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
2
Rotatable Bonds
4
Ring Count
5
Aromatic Ring Count
4
cLogP
6.3
TPSA
79.29
Fraction CSP3
0.14
Chiral centers
0.0
Largest ring
6.0
QED
0.38
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
RARA
RARB
RARG
Compound status
probe
Primary Target
Retinoic Acid Receptors
MOA
Antagonist
Source data