General
Preferred name
RAUBASINE
Synonyms
Ajmalicine hydrochloride ()
ajmalicine ()
Rauwolfia serpentina root ()
RAUWOLFIA SERPENTINA ()
P&D ID
PD050912
CAS
4373-34-6
483-04-5
Tags
natural product
drug
available
Drug indication
Circulatory disorder
Drug Status
experimental
approved
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 An extract of the Rauwolfia serpentina plant (Indian snakeroot). Structurally related to . (GtoPdb)
Compound Sets
7
Cayman Chemical Bioactives
31213
DrugBank
DB15949
DrugMAP
DMPOD47
DrugMAP Approved Drugs
DMPOD47
Guide to Pharmacology
8746
Other bioactive compounds
ZINC Tool Compounds
ZINC000053147422
External IDs
37
Properties
(calculated by RDKit )
Molecular Weight
352.18
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
5
Aromatic Ring Count
2
cLogP
3.18
TPSA
54.56
Fraction CSP3
0.48
Chiral centers
4.0
Largest ring
6.0
QED
0.8
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
AChE
Source data