UCSF

ZINC19392861

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 18 Yes

Other Names:

MFCD09806530

MFCD21090480

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) 1.34 5.19 -51.96 2 4 1 46 249.334 4
Mid Mid (pH 6-8) 1.34 3.82 -9.05 1 4 0 42 248.326 4

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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