UCSF

ZINC00001086

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 14 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) 1.35 4.78 -113.41 0 4 -2 80 198.218 2

Vendor Notes

Note Type Comments Provided By
Melting_Point 183-188? Alfa-Aesar
Melting_Point 183-188° Alfa-Aesar

Activity (Go SEA)

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