UCSF

ZINC03872191

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) -1.74 -6.96 -51.88 4 9 -1 150 252.21 4
Lo Low (pH 4.5-6) -4.74 -6.73 -57.99 5 9 0 152 253.218 4

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 9.78e+00 g/l DrugBank-experimental

Activity (Go SEA)

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