UCSF

ZINC03831522

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 11 No

Download: MOL2 SDF SMILES Flexibase

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) 0.14 3.01 -44.98 3 5 -1 80 166.189 0

Vendor Notes

Note Type Comments Provided By
Melting_Point >360? Alfa-Aesar
Melting_Point >360° Alfa-Aesar

Activity (Go SEA)

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

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