General Information of the Compound
Compound ID |
CP0127622
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Compound Name |
1-(6-fluorospiro[chroman-2,4'-piperidine]-1'-yl)-3-phenylpropan-1-one
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Structure |
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Formula |
C22H24FNO2
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Molecular Weight |
353.437
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Canonical SMILES |
Fc1ccc2OC3(CCN(CC3)C(=O)CCc3ccccc3)CCc2c1
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InChI |
InChI=1S/C22H24FNO2/c23-19-7-8-20-18(16-19)10-11-22(26-20)12-14-24(15-13-22)21(25)9-6-17-4-2-1-3-5-17/h1-5,7-8,16H,6,9-15H2
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InChIKey |
DZCNPAGZPPBTBP-UHFFFAOYSA-N
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Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound