UCSF

ZINC00153928

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) 0.95 1.44 -58.04 2 4 -1 75 166.156 2
Hi High (pH 8-9.5) 2.48 6.8 -92.73 7 8 2 122 466.561 6

Vendor Notes

Note Type Comments Provided By
MP 77-79o C Indofine
MP 81 - 83 Enamine Building Blocks
MP 81...83 Enamine Building Blocks
MP 83-86° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Purity 98% Fluorochem
MP >85(dec.) Indofine
MP >85°(dec) Matrix Scientific
MP >85°C Fluorochem
Melting_Point ca 85? dec. Alfa-Aesar
Melting_Point ca 85° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific
SOLUBILITY Soluble in Chloroform Indofine

Activity (Go SEA)

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