UCSF

ZINC02042189

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 20 Yes

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) 2.52 -0.37 -9.2 1 4 0 55 270.284 2

Vendor Notes

Note Type Comments Provided By
APPEARANCE .; Off white crystals Indofine
SOLUBILITY .; Soluble in hot aqueous Methanol Indofine
M.P. 172-174 C Indofine
MP 172-174o C Indofine
SOLUBILITY Soluble in hot aqueous methanol Indofine

Activity (Go SEA)

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