UCSF

ZINC02566148

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 22 Yes

CAS Number: 35241-54-4

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) 3.73 -0.62 -10.65 2 5 0 75 302.326 6

Vendor Notes

Note Type Comments Provided By
MP 133-137o C Indofine
M.P. 147 C Indofine
SOLUBILITY Toluene/ethyl formate/formic acid Indofine

Activity (Go SEA)

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