UCSF

ZINC03629579

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) 2.42 7.67 -53.59 0 3 -1 53 226.683 6
Lo Low (pH 4.5-6) 2.42 8.09 -35.62 1 3 0 54 227.691 6

Activity (Go SEA)

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