General
Preferred name
TRIBENOSIDE
Synonyms
best guess CB-2431 ()
Hemocuron ()
21401-BA ()
P&D ID
PD013158
CAS
10310-32-4
Tags
natural product
drug
available
Drug Status
experimental
approved
Drug indication
Sclerosing Agent
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
8
Cayman Chemical Bioactives
ChEMBL Drugs
DrugBank
DrugCentral
DrugCentral Approved Drugs
NPC Screening Collection
Prestwick Chemical Library
ReFrame library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
20
Properties
(calculated by RDKit )
Molecular Weight
478.24
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
1
Rotatable Bonds
13
Ring Count
4
Aromatic Ring Count
3
cLogP
4.5
TPSA
66.38
Fraction CSP3
0.38
Chiral centers
5.0
Largest ring
6.0
QED
0.39
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
