UCSF

ZINC05752191

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) 2.07 -1.81 -16.52 3 5 0 94 410.457 2

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.16e-02 g/l DrugBank-approved
ALOGPS_SOLUBILITY 8.53e-02 g/l DrugBank-approved

Activity (Go SEA)

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