General Information of the Compound
| Compound ID |
CP0473099
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| Compound Name |
N-[2-(4,7-dioxo-5-pyridin-3-yl-1H-indol-3-yl)ethyl]benzamide
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| Structure |
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| Formula |
C22H17N3O3
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| Molecular Weight |
371.396
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| Canonical SMILES |
O=C(NCCc1c[nH]c2c1C(=O)C(=CC2=O)c1cccnc1)c1ccccc1
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| InChI |
InChI=1S/C22H17N3O3/c26-18-11-17(15-7-4-9-23-12-15)21(27)19-16(13-25-20(18)19)8-10-24-22(28)14-5-2-1-3-6-14/h1-7,9,11-13,25H,8,10H2,(H,24,28)
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| InChIKey |
MIPXUWQCOJQDEV-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