UCSF

ZINC16597925

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2008 24 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) 3.19 7.62 -42.21 1 5 -1 70 338.412 3
Mid Mid (pH 6-8) 2.73 8.9 -13.53 2 5 0 67 339.42 3

Activity (Go SEA)

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