UCSF

ZINC08535863

Substance Information

In ZINC since Heavy atoms Benign functionality
July 31st, 2006 28 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.83 0.62 -11.28 4 7 0 107 376.416 4
Mid Mid (pH 6-8) 2.37 3.48 -23.92 4 7 0 107 376.416 4

Activity (Go SEA)

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