General
Preferred name
METHYLDOPA (RACEMIC)
Synonyms
(±)-3-(3,4-dihydroxyphenyl)-2-methyl-DL-alanine ()
METHYLDOPA ()
Dl-methyldopa ()
2-Amino-3-(3,4-Dihydroxy-Phenyl)-2- Methyl-Propionic Acid(Catechol Metabolite) ()
Dl-.alpha.-methyl dopa ()
Racemic .alpha.-methyldopa ()
Methyldopa dl-form ()
P&D ID
PD002728
CAS
555-29-3
555-30-6
Tags
drug candidate
natural product
available
Drug Status
investigational
Max Phase
Phase 1
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 L-aromatic amino acid decarboxylase inhibitor; antihypertensive (LOPAC library)
Compound Sets
5
ChEMBL Drugs
CHEMBL718
DrugMatrix
LOPAC library
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL718
NIH Clinical Collections (NCC)
External IDs
25
Properties
(calculated by RDKit )
Molecular Weight
211.08
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
4
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
0.44
TPSA
103.78
Fraction CSP3
0.3
Chiral centers
1.0
Largest ring
6.0
QED
0.54
QED
0.54
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Selectivity
L-aromatic amino acid decarboxylase
Source data