General Information of the Compound
| Compound ID |
CP0477293
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| Compound Name |
2-[5-[4-(3-chlorophenyl)piperazin-1-yl]pentanoylamino]benzamide
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| Structure |
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| Formula |
C22H27ClN4O2
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| Molecular Weight |
414.937
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| Canonical SMILES |
NC(=O)c1ccccc1NC(=O)CCCCN1CCN(CC1)c1cccc(Cl)c1
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| InChI |
InChI=1S/C22H27ClN4O2/c23-17-6-5-7-18(16-17)27-14-12-26(13-15-27)11-4-3-10-21(28)25-20-9-2-1-8-19(20)22(24)29/h1-2,5-9,16H,3-4,10-15H2,(H2,24,29)(H,25,28)
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| InChIKey |
OAEVWQRDEIRERG-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7