General
Preferred name
DECOYININE
Synonyms
Angustmycin A ()
P&D ID
PD015664
CAS
1373-27-9
2004-04-8
Tags
available
drug candidate
Drug indication
Discovery agent
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 Decoyinine is a selective inhibitor of GMP synthetase (GMPS).
Compound Sets
3
Cayman Chemical Bioactives
13851
DrugMAP
DMHO3N1
MedChem Express Bioactive Compound Library
HY-101835
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
279.1
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
4
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
2
cLogP
-1.68
TPSA
139.54
Fraction CSP3
0.36
Chiral centers
3.0
Largest ring
6.0
QED
0.51
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Immunology/Inflammation
Target
Cyclic GMP-AMP Synthase
Source data