General Information of the Compound
| Compound ID |
CP0102529
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| Compound Name |
[3-[2-(dimethylamino)ethyl]-5-methoxyindol-1-yl]-phenylmethanone
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| Structure |
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| Formula |
C20H22N2O2
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| Molecular Weight |
322.408
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| Canonical SMILES |
COc1ccc2n(cc(CCN(C)C)c2c1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C20H22N2O2/c1-21(2)12-11-16-14-22(20(23)15-7-5-4-6-8-15)19-10-9-17(24-3)13-18(16)19/h4-10,13-14H,11-12H2,1-3H3
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| InChIKey |
JQCCQHBMYRBHBD-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