General Information of the Compound
| Compound ID |
CP0483446
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| Compound Name |
6-cyclopentyl-2-(o-tolylethynyl)-7,8-dihydro-1,6-naphthyridin-5(6H)-one
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| Structure |
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| Formula |
C22H22N2O
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| Molecular Weight |
330.431
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| Canonical SMILES |
Cc1ccccc1C#Cc1ccc2C(=O)N(CCc2n1)C1CCCC1
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| InChI |
InChI=1S/C22H22N2O/c1-16-6-2-3-7-17(16)10-11-18-12-13-20-21(23-18)14-15-24(22(20)25)19-8-4-5-9-19/h2-3,6-7,12-13,19H,4-5,8-9,14-15H2,1H3
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| InChIKey |
JJBICBPVIBACLZ-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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Map of Molecular Bioactivity Related to the Compound
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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