General Information of the Compound
| Compound ID |
CP0498574
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| Compound Name |
1,2-Dihydro-N-methyl-4-(4-phenoxybutoxy)quinolin-2-one
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| Structure |
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| Formula |
C20H21NO3
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| Molecular Weight |
323.392
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| Canonical SMILES |
Cn1c2ccccc2c(OCCCCOc2ccccc2)cc1=O
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| InChI |
InChI=1S/C20H21NO3/c1-21-18-12-6-5-11-17(18)19(15-20(21)22)24-14-8-7-13-23-16-9-3-2-4-10-16/h2-6,9-12,15H,7-8,13-14H2,1H3
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| InChIKey |
HEQSJAXXMIOART-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