General Information of the Compound
| Compound ID |
CP0559977
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| Compound Name |
1-(4-chloro-3,5-difluorophenyl)-N-cyclobutylpyrrolo[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C18H14ClF2N3O
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| Molecular Weight |
361.779
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| Canonical SMILES |
Fc1cc(cc(F)c1Cl)-n1c(cc2cccnc12)C(=O)NC1CCC1
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| InChI |
InChI=1S/C18H14ClF2N3O/c19-16-13(20)8-12(9-14(16)21)24-15(18(25)23-11-4-1-5-11)7-10-3-2-6-22-17(10)24/h2-3,6-9,11H,1,4-5H2,(H,23,25)
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| InChIKey |
NBOZDTZYMLXAHW-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