General Information of the Compound
| Compound ID |
CP0558761
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| Compound Name |
2-[[2-(8-fluoro-1,3,4,5-tetrahydro-2-benzazepin-2-yl)-6-methylquinolin-4-yl]amino]acetamide
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| Structure |
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| Formula |
C22H23FN4O
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| Molecular Weight |
378.451
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| Canonical SMILES |
Cc1ccc2nc(cc(NCC(N)=O)c2c1)N1CCCc2ccc(F)cc2C1
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| InChI |
InChI=1S/C22H23FN4O/c1-14-4-7-19-18(9-14)20(25-12-21(24)28)11-22(26-19)27-8-2-3-15-5-6-17(23)10-16(15)13-27/h4-7,9-11H,2-3,8,12-13H2,1H3,(H2,24,28)(H,25,26)
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| InChIKey |
HJKRULSUYDXCCS-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