UCSF

ZINC50055044

Substance Information

In ZINC since Heavy atoms Benign functionality
October 15th, 2010 20 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) 2.25 9.7 -51.02 1 6 1 77 281.332 8
Hi High (pH 8-9.5) 2.25 7.96 -9.13 0 6 0 75 280.324 8

Activity (Go SEA)

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