UCSF

ZINC00156741

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 14 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) 2.69 1.4 -53.59 0 3 -1 53 187.174 2

Vendor Notes

Note Type Comments Provided By
mp 100 MolMall (formerly Molecular Diversity Preservation International)
MP 153 - 155 Enamine Building Blocks
MP 153...155 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

Activity (Go SEA)

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