General Information of the Compound
| Compound ID |
CP0082148
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| Compound Name |
1-(2,2,4-Trimethyl-2,10-dihydro-1H-indeno[1,2-g]quinolin-8-yl)-ethanone
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| Structure |
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| Formula |
C21H21NO
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| Molecular Weight |
303.405
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| Canonical SMILES |
CC(=O)c1ccc-2c(Cc3cc4NC(C)(C)C=C(C)c4cc-23)c1
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| InChI |
InChI=1S/C21H21NO/c1-12-11-21(3,4)22-20-9-16-8-15-7-14(13(2)23)5-6-17(15)19(16)10-18(12)20/h5-7,9-11,22H,8H2,1-4H3
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| InChIKey |
QROLJIOISIOIPO-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