UCSF

ZINC01668580

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) 2.50 2.14 -5.47 0 1 0 17 186.613 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 100-103?/3mm Alfa-Aesar
Boiling_Point 100-103°/3mm Alfa-Aesar
BP 103 / 3 TCI
Melting_Point 46-49? Alfa-Aesar
Melting_Point 46-49° Alfa-Aesar
MP 47 TCI
MP 47 - 49 Enamine Building Blocks
MP 47...49 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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