UCSF

ZINC06563442

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2006 19 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) 3.59 5.65 -10.62 3 5 0 70 258.325 3
Mid Mid (pH 6-8) 3.59 5.65 -9.49 3 5 0 70 258.325 3

Activity (Go SEA)

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