UCSF

ZINC00393813

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) 4.70 8.21 -7.49 1 3 0 47 262.349 3
Hi High (pH 8-9.5) 4.70 9.21 -52.05 0 3 -1 49 261.341 3

Vendor Notes

Note Type Comments Provided By
BP 165 / 4 TCI
Therapy UV screen, analgesic SMDC Pharmakon

Activity (Go SEA)

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