UCSF

ZINC34800261

Annotations

Vendors

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) -1.56 2.78 -47.13 4 7 0 134 226.188 4

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.49e+00 g/l DrugBank-experimental
MP 233-235 °C (dec.)(lit.) Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% min. APIChem
Purity >98% Fluorochem
Melting_Point ca 230? dec. Alfa-Aesar
Melting_Point ca 230° dec. Alfa-Aesar

Activity (Go SEA)

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