General
Preferred name
L-2-aminoadipic acid
Synonyms
(S)-Aminoadipic Acid ()
2-Amino-Hexanedioic Acid ()
(S)-2-AMINOADIPIC ACID ()
L-.alpha.-Aminoadipic Acid ()
P&D ID
PD015453
CAS
626-71-1
1118-90-7
Tags
natural product
available
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 Glutamine synthetase inhibitor (LOPAC library)
Compound Sets
2
Cayman Chemical Bioactives
LOPAC library
External IDs
37
Properties
(calculated by RDKit )
Molecular Weight
161.07
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
3
Rotatable Bonds
5
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.35
TPSA
100.62
Fraction CSP3
0.67
Chiral centers
1.0
Largest ring
0.0
QED
0.51
QED
0.51
Structural alerts
2
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Custom attributes
(extracted from source data)
Selectivity
Glutamine synthetase
Source data