General Information of the Compound
| Compound ID |
CP0387431
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| Compound Name |
7-(Dimethylamino)-4-methyl-3-(4-methylpiperazin-1-yl)-2Hchromen-2-one
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| Structure |
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| Formula |
C17H23N3O2
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| Molecular Weight |
301.39
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| Canonical SMILES |
CN(C)c1ccc2c(C)c(N3CCN(C)CC3)c(=O)oc2c1
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| InChI |
InChI=1S/C17H23N3O2/c1-12-14-6-5-13(18(2)3)11-15(14)22-17(21)16(12)20-9-7-19(4)8-10-20/h5-6,11H,7-10H2,1-4H3
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| InChIKey |
OAAAHFCYRYRNQC-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