General Information of the Compound
| Compound ID |
CP0568128
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| Compound Name |
6-[4-(3-chlorophenyl)piperazin-1-yl]hexylurea
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| Structure |
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| Formula |
C17H27ClN4O
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| Molecular Weight |
338.883
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| Canonical SMILES |
NC(=O)NCCCCCCN1CCN(CC1)c1cccc(Cl)c1
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| InChI |
InChI=1S/C17H27ClN4O/c18-15-6-5-7-16(14-15)22-12-10-21(11-13-22)9-4-2-1-3-8-20-17(19)23/h5-7,14H,1-4,8-13H2,(H3,19,20,23)
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| InChIKey |
FQNXFBTXLFBRQD-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor