General Information of the Compound
| Compound ID |
CP0434747
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| Compound Name |
6-nitro-2-(2-pyridinyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
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| Structure |
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| Formula |
C17H9N3O4
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| Molecular Weight |
319.276
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| Canonical SMILES |
[O-][N+](=O)c1ccc2C(=O)N(C(=O)c3cccc1c23)c1ccccn1
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| InChI |
InChI=1S/C17H9N3O4/c21-16-11-5-3-4-10-13(20(23)24)8-7-12(15(10)11)17(22)19(16)14-6-1-2-9-18-14/h1-9H
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| InChIKey |
VKPMTGRKRHPLGR-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06101, Latent membrane protein 1