UCSF

ZINC19412873

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) 0.33 2.72 -38.09 3 4 1 59 220.296 3
Hi High (pH 8-9.5) 0.33 1.43 -9.87 2 4 0 54 219.288 3
Lo Low (pH 4.5-6) 0.33 3.1 -90.18 4 4 2 60 221.304 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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