General Information of the Compound
| Compound ID |
CP0261160
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| Compound Name |
N-(3-chloro-4-fluorophenyl)-1-(3-chloropyrazin-2-yl)piperidine-4-carboxamide
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| Structure |
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| Formula |
C16H15Cl2FN4O
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| Molecular Weight |
369.227
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| Canonical SMILES |
Fc1ccc(NC(=O)C2CCN(CC2)c2nccnc2Cl)cc1Cl
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| InChI |
InChI=1S/C16H15Cl2FN4O/c17-12-9-11(1-2-13(12)19)22-16(24)10-3-7-23(8-4-10)15-14(18)20-5-6-21-15/h1-2,5-6,9-10H,3-4,7-8H2,(H,22,24)
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| InChIKey |
LXJXHZVHXDSQMA-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