UCSF

ZINC01442762

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) 1.94 3.76 -9.19 1 5 0 60 224.26 4
Mid Mid (pH 6-8) 1.94 3.43 -25.27 2 5 1 62 225.268 4

Vendor Notes

Note Type Comments Provided By
MP 124-127° 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.