UCSF

ZINC06483826

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 19 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) -0.22 2.5 -10.76 2 5 0 62 278.333 1
Hi High (pH 8-9.5) -0.22 3.42 -42.54 1 5 -1 65 277.325 1

Activity (Go SEA)

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