General Information of the Compound
| Compound ID |
CP0372930
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| Compound Name |
7-{[2-(3,4-Dimethyl-phenylamino)-ethylamino]-methyl}-chromen-2-one
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| Structure |
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| Formula |
C20H22N2O2
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| Molecular Weight |
322.408
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| Canonical SMILES |
Cc1ccc(NCCNCc2ccc3ccc(=O)oc3c2)cc1C
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| InChI |
InChI=1S/C20H22N2O2/c1-14-3-7-18(11-15(14)2)22-10-9-21-13-16-4-5-17-6-8-20(23)24-19(17)12-16/h3-8,11-12,21-22H,9-10,13H2,1-2H3
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| InChIKey |
VAZVHJKQIRAJMO-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