UCSF

ZINC36822608

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2009 11 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) -0.23 -0.14 -10.92 3 3 0 55 148.165 0
Mid Mid (pH 6-8) -0.16 -1.84 -31.05 4 3 1 60 149.173 0

Vendor Notes

Note Type Comments Provided By
MP 237 - 239 Enamine Building Blocks
MP 237...239 Enamine Building Blocks
MP 244 - 246 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% )