UCSF

ZINC18810124

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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) 0.65 2.13 -7.73 2 5 0 85 139.114 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 185-190? Alfa-Aesar
Melting_Point 185-190° Alfa-Aesar
Mp [°C] 186 - 190 Acros Organics
MP 186-188° Oakwood Chemical
MP 187-188° Fluorochem
MP 188 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 98% Fluorochem
PUBCHEM_PATENT_ID EP0910565A1; US6048900; WO1998035957A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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