General
Preferred name
HC-Toxin
Synonyms
HC Toxin ()
P&D ID
PD121532
CAS
83209-65-8
Tags
obsolete probe
drug candidate
natural product
Drug indication
Solid tumour/cancer
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 ]]
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
7
Properties
(calculated by RDKit )
Molecular Weight
436.23
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
3
Rotatable Bonds
7
Ring Count
3
Aromatic Ring Count
0
cLogP
-0.6
TPSA
137.21
Fraction CSP3
0.76
Chiral centers
5.0
Largest ring
12.0
QED
0.36
Structural alerts
1
historic compounds (Chemical Probes.org)
Obsolete
Related compounds
Custom attributes
(extracted from source data)
Therapeutic Class
Anticancer Agents
Source data
