General Information of the Compound
| Compound ID |
CP0376759
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| Compound Name |
N-[[4-(methoxymethoxy)phenyl]methyl]-6-[4-[2-(4-methoxyphenyl)phenyl]piperazin-1-yl]hexanamide
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| Structure |
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| Formula |
C32H41N3O4
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| Molecular Weight |
531.697
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| Canonical SMILES |
COCOc1ccc(CNC(=O)CCCCCN2CCN(CC2)c2ccccc2-c2ccc(OC)cc2)cc1
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| InChI |
InChI=1S/C32H41N3O4/c1-37-25-39-29-15-11-26(12-16-29)24-33-32(36)10-4-3-7-19-34-20-22-35(23-21-34)31-9-6-5-8-30(31)27-13-17-28(38-2)18-14-27/h5-6,8-9,11-18H,3-4,7,10,19-25H2,1-2H3,(H,33,36)
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| InChIKey |
AKRZFAUTJFZOAO-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: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor