General
Preferred name
LOMETRALINE
Synonyms
LOMETRALINE HYDROCHLORIDE ()
Lometraline hcl ()
CP-143681 ()
CP-14368-1 ()
CP-14,368-1 ()
P&D ID
PD066568
CAS
39951-65-0
34552-78-8
30060-91-4
30074-66-9
Tags
available
drug candidate
Drug indication
Antiparkinsonian
Antipsychotic
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
3
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
239.11
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
1
cLogP
3.29
TPSA
12.47
Fraction CSP3
0.54
Chiral centers
1.0
Largest ring
6.0
QED
0.79
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
