UCSF

ZINC49089868

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) 1.56 3.55 -42.24 1 7 -1 102 370.819 2
Lo Low (pH 4.5-6) 1.16 4.31 -18.18 1 7 0 96 371.827 2

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 4.61e-02 g/l DrugBank-approved
Purity 97% Fluorochem

Activity (Go SEA)

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

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