UCSF

ZINC64532119

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 22 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) 0.92 0.98 -13.34 5 5 0 96 300.358 6
Mid Mid (pH 6-8) 0.92 1.28 -52.71 6 5 1 97 301.366 6

Activity (Go SEA)

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