UCSF

ZINC44185345

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) 1.37 3.78 -46.77 1 4 -1 69 195.585 1
Hi High (pH 8-9.5) 4.17 9.15 -13.37 1 6 0 74 393.439 6
Lo Low (pH 4.5-6) 1.37 4.22 -49.4 2 4 0 70 196.593 1

Vendor Notes

Note Type Comments Provided By
Purity 95% 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.