UCSF

ZINC34800266

Substance Information

In ZINC since Heavy atoms Benign functionality
September 25th, 2009 24 No

Download: MOL2 SDF SMILES Flexibase

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 2.05 -53.76 3 7 -1 116 348.404 4

Vendor Notes

Note Type Comments Provided By
M.P 215 °C Indofine
SOLUBILITY H2O: 50 mg/mL, clear, very faintly yellow Indofine

Activity (Go SEA)

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

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