General
Preferred name
MOTRETINIDE
Synonyms
Tasmaderm ()
RO 11-1430 ()
NSC-351523 ()
RO-11-1430 ()
P&D ID
PD072611
CAS
54757-59-4
56281-36-8
Tags
natural product
drug
Drug Status
experimental
approved
Drug indication
Keratolytic
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
17
Properties
(calculated by RDKit )
Molecular Weight
353.24
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
7
Ring Count
1
Aromatic Ring Count
1
cLogP
5.22
TPSA
38.33
Fraction CSP3
0.35
Chiral centers
0.0
Largest ring
6.0
QED
0.54
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
