UCSF

ZINC05322884

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 21 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
Mid Mid (pH 6-8) 3.43 8.11 -10.09 2 4 0 58 277.327 3
Mid Mid (pH 6-8) 3.43 8.13 -11.55 2 4 0 58 277.327 3

Activity (Go SEA)

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