UCSF

ZINC00541493

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 26 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) 3.11 11.71 -17.74 0 8 0 98 349.35 4
Mid Mid (pH 6-8) 3.11 12.23 -42.23 1 8 1 99 350.358 4

Activity (Go SEA)

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