UCSF

ZINC85550138

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) -4.15 -6.92 -140.06 4 9 -2 170 258.119 7
Mid Mid (pH 6-8) -4.15 -8.07 -52.3 5 9 -1 168 259.127 7

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.32e+01 g/l DrugBank-experimental

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.