UCSF

ZINC96508946

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2014 10 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) -2.53 7.73 -30.47 0 1 1 0 138.234 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 220? dec. Alfa-Aesar
Melting_Point 220° dec. Alfa-Aesar

Activity (Go SEA)

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

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