UCSF

ZINC03843496

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 17 Yes

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 -3.46 -6.3 4 4 0 80 232.235 2

Vendor Notes

Note Type Comments Provided By
mp 255 MolMall (formerly Molecular Diversity Preservation International)
mp 84 - 85 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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