General Information of the Compound
| Compound ID |
CP0555805
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| Compound Name |
1-(4-cyano-3,5-difluorophenyl)-N-cyclopropylpyrrolo[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C18H12F2N4O
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| Molecular Weight |
338.317
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| Canonical SMILES |
Fc1cc(cc(F)c1C#N)-n1c(cc2cccnc12)C(=O)NC1CC1
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| InChI |
InChI=1S/C18H12F2N4O/c19-14-7-12(8-15(20)13(14)9-21)24-16(18(25)23-11-3-4-11)6-10-2-1-5-22-17(10)24/h1-2,5-8,11H,3-4H2,(H,23,25)
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| InChIKey |
APMVSVJFNSJVQO-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