UCSF

ZINC03830942

Annotations

Vendors

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) 4.02 4.21 -5.41 1 2 0 33 396.953 0
Mid Mid (pH 6-8) 4.02 4.98 -38.78 0 2 -1 36 395.945 0

Vendor Notes

Note Type Comments Provided By
MP 200 - 202 Enamine Building Blocks
MP 200...202 Enamine Building Blocks
mp 202 MolMall (formerly Molecular Diversity Preservation International)
MP 205 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Therapy antiamebic SMDC Iconix

Activity (Go SEA)

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

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