UCSF

ZINC34217290

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 16 Yes

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.01 9.4 -34.92 1 1 1 4 214.332 0
Hi High (pH 8-9.5) 3.01 8.04 -1.91 0 1 0 3 213.324 0

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z104302-1-O Glutamate NMDA Receptor (cluster #1 Of 7), Other Other 240 0.58 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z104302 Z104302 Glutamate NMDA Receptor 240 0.58 Binding ≤ 1μM
Z104302 Z104302 Glutamate NMDA Receptor 240 0.58 Binding ≤ 10μM

Analogs ( Draw Identity 99% 90% 80% 70% )