General Information of the Compound
| Compound ID |
CP0381161
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| Compound Name |
7-(2,6-dimethylphenyl)-N,N-dimethylchroman-3-amine
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| Structure |
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| Formula |
C19H23NO
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| Molecular Weight |
281.399
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| Canonical SMILES |
CN(C)C1COc2cc(ccc2C1)-c1c(C)cccc1C
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| InChI |
InChI=1S/C19H23NO/c1-13-6-5-7-14(2)19(13)16-9-8-15-10-17(20(3)4)12-21-18(15)11-16/h5-9,11,17H,10,12H2,1-4H3
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| InChIKey |
IGHWTHSZUYPPRK-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