UCSF

ZINC58649939

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2011 27 Yes

Popular Name: VU 0364439 VU 0364439

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1246086-78-1 , [1246086-78-1]

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) 3.66 5.88 -49.61 1 6 -1 90 421.285 5 ↓
Lo Low (pH 4.5-6) 3.66 5.43 -14.61 2 6 0 88 422.293 5 ↓

Vendor Notes

Note Type Comments Provided By
Target GluR Selleck Chemicals

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
GRM4-2-E Metabotropic Glutamate Receptor 4 (cluster #2 Of 3), Eukaryotic Eukaryotes 20 0.40 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
GRM4_HUMAN Q14833 Metabotropic Glutamate Receptor 4, Human 19.8 0.40 Binding ≤ 1μM
GRM4_HUMAN Q14833 Metabotropic Glutamate Receptor 4, Human 19.8 0.40 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Class C/3 (Metabotropic glutamate/pheromone receptors)
G alpha (i) signalling events

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

No pre-computed analogs available. Try a structural similarity search.