UCSF

ZINC19426297

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 13 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) -0.46 0.94 -34.12 4 5 1 74 181.219 3
Ref Reference (pH 7) -0.59 1.39 -30.82 4 5 1 76 181.219 2
Mid Mid (pH 6-8) -0.46 1.34 -88.02 5 5 2 75 182.227 3

Vendor Notes

Note Type Comments Provided By
MP 129 - 131 Enamine Building Blocks
MP 129...131 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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