UCSF

ZINC33829403

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) 4.32 13.13 -37.24 1 4 1 34 381.54 9
Lo Low (pH 4.5-6) 4.32 15.34 -98.68 2 4 2 35 382.548 9
Lo Low (pH 4.5-6) 4.32 13.16 -35.22 1 4 1 34 381.54 9

Activity (Go SEA)

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