UCSF

ZINC03830997

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) 0.83 0.47 -40.97 6 8 1 124 407.553 7
Hi High (pH 8-9.5) 0.83 -2.31 -17.24 5 8 0 122 406.545 7

Vendor Notes

Note Type Comments Provided By
Molecular_Solubility 1.785 Bitter DB

Activity (Go SEA)

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