UCSF

ZINC05699862

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) 2.23 -0.98 -48.96 2 4 1 43 302.394 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0608893A1; EP1003494A1; US4126684; US5321012; US5556838; US5654281; US6008258; WO1998031358A1 IBM Patent Data

Activity (Go SEA)

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