General Information of the Compound
| Compound ID |
CP0298731
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| Compound Name |
5-oxo-5-(7-oxo-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridin-1-yl)pentanoic acid
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| Structure |
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| Formula |
C16H18N2O4
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| Molecular Weight |
302.33
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| Canonical SMILES |
OC(=O)CCCC(=O)N1CCc2cccc3C(=O)NCC1c23
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| InChI |
InChI=1S/C16H18N2O4/c19-13(5-2-6-14(20)21)18-8-7-10-3-1-4-11-15(10)12(18)9-17-16(11)22/h1,3-4,12H,2,5-9H2,(H,17,22)(H,20,21)
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| InChIKey |
CFOCNCPFSCAEMG-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