UCSF

ZINC13719791

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 10 Yes

Popular Name: GLYCINE GLYCINE

Find On: PubMed — Wikipedia — Google

CAS Number: 138199-51-6

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) -3.91 -2.29 -61.82 3 7 -1 121 142.098 2 ↓
Hi High (pH 8-9.5) -3.91 -2.6 -100.5 2 7 -2 119 141.09 2 ↓
Lo Low (pH 4.5-6) -3.91 -2.29 -37.88 4 7 0 122 143.106 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z104302-3-O Glutamate NMDA Receptor (cluster #3 Of 7), Other Other 98 0.98 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z104302 Z104302 Glutamate NMDA Receptor 70 1.00 Binding ≤ 1μM
Z104302 Z104302 Glutamate NMDA Receptor 2030 0.80 Binding ≤ 10μM

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