UCSF

ZINC02455287

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) 3.94 7.95 -7.85 2 2 0 39 252.342 2
Hi High (pH 8-9.5) 3.94 8.01 -37.73 1 2 -1 36 251.334 2
Lo Low (pH 4.5-6) 3.94 8.31 -31.42 3 2 1 40 253.35 2

Vendor Notes

Note Type Comments Provided By
MP 208-210o C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Fluorochem
Warnings IRRITANT Matrix Scientific
SOLUBILITY Soluble in Methanol Indofine

Activity (Go SEA)

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