UCSF

ZINC19509531

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 11 Yes

Popular Name: 3-(5-bromothiophen-2-yl)-3-oxopropanenitrile 3-(5-bromothiophen-2-yl)-3-oxopr…

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CAS Numbers: 71683-02-8 , [71683-02-8]

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) 1.75 5.28 -11.68 0 2 0 41 230.086 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 143 - 145 Enamine Building Blocks
MP 143...145 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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