UCSF

ZINC26391949

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 42 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) 5.62 8.39 -20.69 2 10 0 138 570.55 10
Mid Mid (pH 6-8) 5.62 10.28 -111.56 0 10 -2 143 568.534 10

Activity (Go SEA)

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