General Information of the Compound
| Compound ID |
CP0443444
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| Compound Name |
N-[2-[4-(4-methylphenyl)piperazin-1-yl]ethyl]quinoxaline-2-carboxamide
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| Structure |
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| Formula |
C22H25N5O
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| Molecular Weight |
375.476
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| Canonical SMILES |
Cc1ccc(cc1)N1CCN(CCNC(=O)c2cnc3ccccc3n2)CC1
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| InChI |
InChI=1S/C22H25N5O/c1-17-6-8-18(9-7-17)27-14-12-26(13-15-27)11-10-23-22(28)21-16-24-19-4-2-3-5-20(19)25-21/h2-9,16H,10-15H2,1H3,(H,23,28)
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| InChIKey |
HKRRXXVVKCZIRC-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