UCSF

ZINC04344193

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 16 Yes

Popular Name: Methyl 6-chloro-4-oxo-1,4-dihydroquinoline-2-carboxylate Methyl 6-chloro-4-oxo-1,4-dihydr…

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CAS Numbers: 7545-52-0 , [7545-52-0]

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) 1.60 5.44 -12.09 1 4 0 59 237.642 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 179 - 181 Enamine Building Blocks
MP 179...181 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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