General Information of the Compound
| Compound ID |
CP0509378
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| Compound Name |
1-Oxo-1,2,6,7-tetrahydro-benzo[6,7]azepino[3,2,1-hi]indole-2-carboxylic acid (2,4-difluoro-phenyl)-amide
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| Structure |
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| Formula |
C23H16F2N2O2
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| Molecular Weight |
390.389
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| Canonical SMILES |
Fc1ccc(NC(=O)C2C(=O)N3c4c2cccc4CCc2ccccc32)c(F)c1
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| InChI |
InChI=1S/C23H16F2N2O2/c24-15-10-11-18(17(25)12-15)26-22(28)20-16-6-3-5-14-9-8-13-4-1-2-7-19(13)27(21(14)16)23(20)29/h1-7,10-12,20H,8-9H2,(H,26,28)
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| InChIKey |
GVIHCQGAPIJNIA-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