UCSF

ZINC04348946

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) 0.33 -11.59 -15.15 6 10 0 166 434.397 4

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 2.048 Bitter DB
APPEARANCE .; Cream colored powder Indofine
M.P. 222-224 C Indofine
MP 222-224o C Indofine
SOLUBILITY 5 mg/20ml ethanol Indofine
PUBCHEM_PATENT_ID EP0065123A1; EP0416713A1; EP0416713B2; EP0719554A1; EP0742012A2; US3984394; US4031260; US4617293; US4971812; US5650433; WO1989000806A1; WO2000043490A2 IBM Patent Data
SOLUBILITY Soluble in 5 mg/20 ml ethanol Indofine
SOLUBILITY Soluble in 5mg/20ml Ethanol Indofine

Activity (Go SEA)

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