General Information of the Compound
| Compound ID |
CP0493646
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| Compound Name |
10-oxo-3-pyridin-3-yl-5H-indeno[1,2-b]indole-7-carbonitrile
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| Structure |
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| Formula |
C21H11N3O
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| Molecular Weight |
321.339
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| Canonical SMILES |
O=C1c2ccc(cc2-c2[nH]c3cc(ccc3c12)C#N)-c1cccnc1
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| InChI |
InChI=1S/C21H11N3O/c22-10-12-3-5-16-18(8-12)24-20-17-9-13(14-2-1-7-23-11-14)4-6-15(17)21(25)19(16)20/h1-9,11,24H
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| InChIKey |
RIUTWWHRMZIYJN-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