UCSF

ZINC12360022

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 19 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.73 -2.54 -7.49 0 5 0 46 274.357 0

Vendor Notes

Note Type Comments Provided By
Boiling_Point 180?/0.4mm Alfa-Aesar
Boiling_Point 180°/0.4mm Alfa-Aesar

Activity (Go SEA)

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

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