UCSF

ZINC13776854

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) -2.37 1.3 -197.46 2 14 -3 210 406.164 4
Lo Low (pH 4.5-6) -2.37 1.56 -168.43 3 14 -2 211 407.172 4
Lo Low (pH 4.5-6) -2.37 -2.82 -176.68 3 14 -2 211 407.172 4

Activity (Go SEA)

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