UCSF

ZINC29485938

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2009 40 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) 5.41 17.11 -13.54 1 7 0 79 538.644 14

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z80295-6-O MT4 (Lymphocytes) (cluster #6 Of 8), Other Other 100 0.25 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z80295 Z80295 MT4 (Lymphocytes) 100 0.25 Functional ≤ 10μM

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