UCSF

ZINC05208883

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) 7.07 -3.35 -63.46 4 4 2 52 430.555 6

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0979078A1; WO1998030218A1 IBM Patent Data

Activity (Go SEA)

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