UCSF

ZINC35024346

Annotations

Vendors

    None

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) 0.38 1.87 -67.62 3 5 0 86 244.316 5
Mid Mid (pH 6-8) 0.38 0.23 -48.69 2 5 -1 85 243.308 5
Lo Low (pH 4.5-6) 0.38 -0.11 -39.89 4 5 1 84 245.324 5

Activity (Go SEA)

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

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