General
Preferred name
hedamycin
Synonyms
P&D ID
PD011198
CAS
11048-97-8
Tags
natural product
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()] ]]
Description
(extracted from source data)
DESCRIPTION
Hedamycin is a microbial metabolite with antibacterial, antitrypanosomal and antitumour activities. It triggers cytotoxic DNA damage in human cells .
(GtoPdb)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
Guide to Pharmacology
NIH Mechanistic Set
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
9
Molecular Weight
746.34
Hydrogen Bond Acceptors
13
Hydrogen Bond Donors
3
Rotatable Bonds
6
Ring Count
8
Aromatic Ring Count
3
cLogP
3.66
TPSA
175.04
Fraction CSP3
0.59
Chiral centers
12.0
Largest ring
6.0
QED
0.24
Structural alerts
1
quinone_A(370)
[!#6&!#1]=[#6]-1-[#6]=,:[#6]-[#6](=[!#6&!#1])-[#6]=,:[#6]-1
PAINS Family A
Related compounds
Custom attributes
(extracted from source data)
Source data
