General Information of the Compound
| Compound ID |
CP0411858
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| Compound Name |
N-[2-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]quinoxaline-2-carboxamide
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| Structure |
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| Formula |
C22H21FN4O
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| Molecular Weight |
376.435
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| Canonical SMILES |
Fc1ccc(cc1)C1=CCN(CCNC(=O)c2cnc3ccccc3n2)CC1
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| InChI |
InChI=1S/C22H21FN4O/c23-18-7-5-16(6-8-18)17-9-12-27(13-10-17)14-11-24-22(28)21-15-25-19-3-1-2-4-20(19)26-21/h1-9,15H,10-14H2,(H,24,28)
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| InChIKey |
JTFKGGVDRVUAII-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