UCSF

ZINC98572925

Substance Information

In ZINC since Heavy atoms Benign functionality
August 2nd, 2015 6 Yes

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) 1.95 4.63 -1.65 0 0 0 0 144.999 0

Vendor Notes

Note Type Comments Provided By
Melting_Point 50-51? Alfa-Aesar
Melting_Point 50-51° Alfa-Aesar

Activity (Go SEA)

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

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