UCSF

ZINC04382916

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2005 30 Yes

Download: MOL2 SDF SMILES Flexibase

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) 5.92 13.98 -11.27 1 4 0 47 421.61 10
Mid Mid (pH 6-8) 5.92 14.37 -33.97 2 4 1 48 422.618 10

Activity (Go SEA)

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