UCSF

ZINC31562147

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) 2.19 3.18 -11.88 1 5 0 59 279.336 6
Hi High (pH 8-9.5) 2.19 4.18 -54.19 0 5 -1 62 278.328 6
Mid Mid (pH 6-8) 2.19 5.48 -47.64 2 5 1 60 280.344 6

Activity (Go SEA)

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