UCSF

ZINC20289185

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 34 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) 2.42 6.19 -62.3 0 8 -1 91 483.928 6
Mid Mid (pH 6-8) 2.42 8.46 -71.15 1 8 0 93 484.936 6

Activity (Go SEA)

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