General
Preferred name
LACCAIC ACID A
Synonyms
LACCACID ACID A ()
P&D ID
PD000700
CAS
15979-35-8
Tags
natural product
available
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
2
Novartis Chemogenetic Library (NIBR MoA Box)
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
537.09
Hydrogen Bond Acceptors
10
Hydrogen Bond Donors
8
Rotatable Bonds
6
Ring Count
4
Aromatic Ring Count
3
cLogP
1.73
TPSA
238.99
Fraction CSP3
0.12
Chiral centers
0.0
Largest ring
6.0
QED
0.13
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)
Member status
member
MOA
Direct competitive inhibitor of DNMT1
Source data
