General Information of the Compound
| Compound ID |
CP0508168
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| Compound Name |
2,3-dihydro-1H-11-oxa-5-aza-benzo[a]trindene-4,6-dione
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| Structure |
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| Formula |
C17H11NO3
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| Molecular Weight |
277.279
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| Canonical SMILES |
O=C1NC(=O)c2c1c1CCCc1c1oc3ccccc3c21
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| InChI |
InChI=1S/C17H11NO3/c19-16-13-8-5-3-6-9(8)15-12(14(13)17(20)18-16)10-4-1-2-7-11(10)21-15/h1-2,4,7H,3,5-6H2,(H,18,19,20)
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| InChIKey |
JKUCXPDIZSGEPM-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