UCSF

ZINC01080967

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 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) 5.94 0.43 -5.39 0 2 0 30 414.48 1

Vendor Notes

Note Type Comments Provided By
M.P. 248-253 C Indofine
MP 248-253o C Indofine
SOLUBILITY Soluble in Chloroform, Benzene Indofine
APPEARANCE Whitish orange fluffy solid Indofine

Activity (Go SEA)

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