UCSF

ZINC01722298

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) 2.27 -0.31 -51.41 2 3 -1 66 164.184 1

Vendor Notes

Note Type Comments Provided By
MP 184-186° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95+% Matrix Scientific
Purity 97% Fluorochem
Melting_Point ca 176? dec. Alfa-Aesar
Melting_Point ca 176° dec. Alfa-Aesar
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Light Sensitive/Air Sensitive Matrix Scientific

Activity (Go SEA)

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

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