UCSF

ZINC19418327

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 10 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) 1.50 2.43 -41.19 1 3 -1 60 165.149 5

Vendor Notes

Note Type Comments Provided By
Melting_Point 108-110? Alfa-Aesar
Melting_Point 108-110° Alfa-Aesar

Activity (Go SEA)

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