UCSF

ZINC11041422

Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2007 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
Ref Reference (pH 7) -0.47 -1.51 -20.27 2 8 0 106 287.279 3
Mid Mid (pH 6-8) -0.47 -1.23 -45.33 3 8 1 107 288.287 3

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.