UCSF

ZINC00091020

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) 2.89 5.64 -9.46 2 2 0 32 252.648 1
Mid Mid (pH 6-8) 3.62 5.34 -36.02 1 2 -1 29 251.64 1

Vendor Notes

Note Type Comments Provided By
MP >300° 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.