General Information of the Compound
| Compound ID |
CP0441760
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| Compound Name |
4,14-diazapentacyclo[11.7.0.0^{2,6}.0^{7,12}.0^{15,20}]icosa-1(13),2(6),7(12),15,17,19-hexaene-3,5-dione
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| Structure |
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| Formula |
C18H14N2O2
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| Molecular Weight |
290.322
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| Canonical SMILES |
O=C1NC(=O)c2c1c1CCCCc1c1[nH]c3ccccc3c21
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| InChI |
InChI=1S/C18H14N2O2/c21-17-14-9-5-1-2-6-10(9)16-13(15(14)18(22)20-17)11-7-3-4-8-12(11)19-16/h3-4,7-8,19H,1-2,5-6H2,(H,20,21,22)
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| InChIKey |
XCUWUKJYHFLWPP-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