General Information of the Compound
| Compound ID |
CP0359944
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| Compound Name |
N-(3-chloro-4-fluorophenyl)-1-(3-cyanopyridin-2-yl)piperidine-4-carboxamide
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| Structure |
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| Formula |
C18H16ClFN4O
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| Molecular Weight |
358.804
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| Canonical SMILES |
Fc1ccc(NC(=O)C2CCN(CC2)c2ncccc2C#N)cc1Cl
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| InChI |
InChI=1S/C18H16ClFN4O/c19-15-10-14(3-4-16(15)20)23-18(25)12-5-8-24(9-6-12)17-13(11-21)2-1-7-22-17/h1-4,7,10,12H,5-6,8-9H2,(H,23,25)
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| InChIKey |
ANBNOJMYLJLOKF-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
Protein ID: PT03110, Mucosa-associated lymphoid tissue lymphoma translocation protein 1