UCSF

ZINC38285889

Substance Information

In ZINC since Heavy atoms Benign functionality
January 14th, 2010 21 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) 3.58 6.99 -12.74 0 4 0 49 282.295 3

Vendor Notes

Note Type Comments Provided By
M.P. 128-130 C Indofine
MP 128-130o C Indofine
APPEARANCE Pale yellow solid Indofine
SOLUBILITY Soluble in Methanol Indofine

Activity (Go SEA)

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