UCSF

ZINC00053961

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) -1.01 -5.58 -54.56 4 6 -1 122 214.226 2
Lo Low (pH 4.5-6) -0.64 -3.61 -14.82 5 6 0 115 215.234 2
Lo Low (pH 4.5-6) -1.01 -5.72 -86.48 5 6 0 123 215.234 2

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Therapy antibacterial SMDC Pharmakon

Activity (Go SEA)

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

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