General Information of the Compound
| Compound ID |
CP0511572
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| Compound Name |
6-(4-amino-3-nitrophenyl)-7-(diethylamino)chromen-2-one
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| Structure |
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| Formula |
C19H19N3O4
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| Molecular Weight |
353.378
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| Canonical SMILES |
CCN(CC)c1cc2oc(=O)ccc2cc1-c1ccc(N)c(c1)[N+]([O-])=O
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| InChI |
InChI=1S/C19H19N3O4/c1-3-21(4-2)16-11-18-13(6-8-19(23)26-18)9-14(16)12-5-7-15(20)17(10-12)22(24)25/h5-11H,3-4,20H2,1-2H3
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| InChIKey |
AQDSLDBDPQOITC-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