UCSF

ZINC00158136

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) 2.28 1.28 -46.84 0 2 -1 40 173.55 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 203-206? Alfa-Aesar
Melting_Point 203-206° Alfa-Aesar
MP 204-208° Matrix Scientific
MP 205 - 210 Enamine Building Blocks
MP 206 TCI
MP 206-208° Matrix Scientific
MP 207 - 209 Enamine Building Blocks
MP 207...209 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.