UCSF

ZINC12844147

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) -1.34 0.77 -11.73 4 5 0 94 158.186 1
Ref Reference (pH 7) -1.21 0.49 -10.13 5 5 0 93 159.194 1
Hi High (pH 8-9.5) -1.34 0.38 -36.77 3 5 -1 91 157.178 1
Hi High (pH 8-9.5) -1.34 0.8 -30.69 3 5 -1 91 157.178 1

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.