UCSF

ZINC42783361

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) 0.71 4.42 -80.34 3 3 2 24 213.369 3
Hi High (pH 8-9.5) 0.71 2.05 -38.15 2 3 1 23 212.361 3
Mid Mid (pH 6-8) 0.71 4.31 -91.46 3 3 2 24 213.369 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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