UCSF

ZINC04264935

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 25 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) 3.66 3.42 -5.48 3 3 0 61 350.543 1

Vendor Notes

Note Type Comments Provided By
mp 218 - 220 MolMall (formerly Molecular Diversity Preservation International)
mp 278 - 280 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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