UCSF

ZINC04900381

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2006 14 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) -2.99 -12.33 -8.2 6 6 0 121 208.21 2

Activity (Go SEA)

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