UCSF

ZINC00389649

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) 3.29 5.82 -2.48 0 0 0 0 189.027 0

Vendor Notes

Note Type Comments Provided By
BP 100 / 50 TCI
Boiling_Point 66-68?/8mm Alfa-Aesar
Boiling_Point 66-68°/8mm Alfa-Aesar
BP 68°/8mm Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% APIChem
Purity 99% 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.