General
Preferred name
HYDRASTINE
Synonyms
HYDRASTINE (1R, 9S) ()
(+)-Hydrastine ()
(-)-¦Â-Hydrastine ()
(1R,9S)-¦Â-Hydrastine ()
(-)-??Hydrastine ()
(1R,9S)-??Hydrastine ()
(-)-β-Hydrastine ()
(1R,9S)-β-Hydrastine ()
(-)-??-Hydrastine, (1R,9S)-??-Hydrastine ()
NSC-757430 ()
Hydrastine hcl ()
HYDRASTINE HYDROCHLORIDE ()
(1R,9S)-(?)-?-Hydrastine ()
P&D ID
PD029710
CAS
118-08-1
5936-28-7
Tags
available
drug candidate
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 Potent competitive GABA-A receptor antagonist which is more potent than bicuculline; isolated from Corydalis stricta (LOPAC library)
Cell lines
0
Organisms
1
Compound Sets
9
Cayman Chemical Bioactives
Drug Repurposing Hub
LOPAC library
MedChem Express Bioactive Compound Library
NPC Screening Collection
ReFrame library
Selleckchem Bioactive Compound Library
The Spectrum Collection
External IDs
65
Properties
(calculated by RDKit )
Molecular Weight
383.14
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
0
Rotatable Bonds
3
Ring Count
5
Aromatic Ring Count
2
cLogP
2.87
TPSA
66.46
Fraction CSP3
0.38
Chiral centers
2.0
Largest ring
6.0
QED
0.76
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Selectivity
GABA-A
MOA
Tyrosine hydroxylase inhibitor
Target
PAK
Source data