UCSF

ZINC00062063

Annotations

Vendors

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) 2.19 5.92 -47.57 0 3 -1 53 186.19 1
Mid Mid (pH 6-8) 2.19 6.31 -43.29 1 3 0 54 187.198 1

Vendor Notes

Note Type Comments Provided By
MP 199 - 201 Enamine Building Blocks
MP 199...201 Enamine Building Blocks
mp 235 MolMall (formerly Molecular Diversity Preservation International)
MP 244° Matrix Scientific
MP 245 - 247 Enamine Building Blocks
MP 245-247° Oakwood Chemical
mp 312 MolMall (formerly Molecular Diversity Preservation International)
purity 9.500000000000000e+001 Enamine Building Blocks
Purity 90% Fluorochem
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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