UCSF

ZINC00155138

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) 2.59 2.51 -5.28 0 1 0 24 200.01 0

Vendor Notes

Note Type Comments Provided By
MP 74-77° Matrix Scientific
MP 76-81° Matrix Scientific
MP 77 - 79 Enamine Building Blocks
Melting_Point 77-81? Alfa-Aesar
Melting_Point 77-81° Alfa-Aesar
MP 77...79 Enamine Building Blocks
MP 78 - 80 Enamine Building Blocks
MP 80 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Matrix Scientific
Warnings IRRITANT-HARMFUL Matrix Scientific

Activity (Go SEA)

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

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