General Information of the Compound
| Compound ID |
CP0514077
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| Compound Name |
1-Oxo-1,2-dihydro-6H-pyrrolo[3,2,1-de]acridine-2-carboxylic acid (2,6-difluoro-phenyl)-amide
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| Structure |
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| Formula |
C22H14F2N2O2
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| Molecular Weight |
376.362
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| Canonical SMILES |
Fc1cccc(F)c1NC(=O)C1C(=O)N2c3c1cccc3Cc1ccccc21
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| InChI |
InChI=1S/C22H14F2N2O2/c23-15-8-4-9-16(24)19(15)25-21(27)18-14-7-3-6-13-11-12-5-1-2-10-17(12)26(20(13)14)22(18)28/h1-10,18H,11H2,(H,25,27)
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| InChIKey |
XBCIWSCYISQLSH-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