General Information of the Compound
| Compound ID |
CP0488118
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| Compound Name |
4-(1H-indol-4-yl)-1-(piperidin-3-ylmethyl)quinolin-2-one
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| Structure |
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| Formula |
C23H23N3O
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| Molecular Weight |
357.457
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| Canonical SMILES |
O=c1cc(-c2cccc3[nH]ccc23)c2ccccc2n1CC1CCCNC1
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| InChI |
InChI=1S/C23H23N3O/c27-23-13-20(17-7-3-8-21-18(17)10-12-25-21)19-6-1-2-9-22(19)26(23)15-16-5-4-11-24-14-16/h1-3,6-10,12-13,16,24-25H,4-5,11,14-15H2
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| InChIKey |
RPCSWDCGTNITFL-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