UCSF

ZINC36177776

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 21 No

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) 5.04 10.77 -45.93 1 4 -1 69 298.447 13

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Q6UB75-1-E Group VII Phospholipase A2 (cluster #1 Of 2), Eukaryotic Eukaryotes 1400 0.39 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Q6UB75_PIG Q6UB75 Group VII Phospholipase A2, Pig 1400 0.39 Binding ≤ 10μM

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