UCSF

ZINC19410905

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 17 Yes

Other Names:

MFCD09816528

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) 3.08 5.62 -40.12 3 3 1 46 274.171 2
Hi High (pH 8-9.5) 3.08 4.33 -7.8 2 3 0 41 273.163 2

Vendor Notes

Note Type Comments Provided By
MP 127 - 129 Enamine Building Blocks
MP 127...129 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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