UCSF

ZINC38526549

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) 2.82 7.66 -128.35 4 2 2 32 254.805 3
Hi High (pH 8-9.5) 2.82 6.49 -44.66 3 2 1 31 253.797 3
Hi High (pH 8-9.5) 2.82 7.24 -31.88 3 2 1 30 253.797 3

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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