UCSF

ZINC35145603

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2009 25 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) 3.70 8.79 -10.52 1 5 0 56 337.423 7
Mid Mid (pH 6-8) 3.70 9.36 -33.93 2 5 1 57 338.431 7

Activity (Go SEA)

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