UCSF

ZINC00039098

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) 0.87 4.22 -47.05 2 4 -1 76 204.205 3

Vendor Notes

Note Type Comments Provided By
MP 145 TCI
Mp [°C] 145 - 147 Acros Organics
ALOGPS_SOLUBILITY 2.12e+00 g/l DrugBank-experimental
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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