General Information of the Compound
| Compound ID |
CP0949886
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| Compound Name |
4-(1-{2-[4-(2-Methoxyethyl)piperazin-1-yl]-2-phenylethyl}piperidin-4-yl)morpholine
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| Structure |
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| Formula |
C24H40N4O2
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| Molecular Weight |
416.61
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| Canonical SMILES |
COCCN1CCN(C(CN2CCC(N3CCOCC3)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C24H40N4O2/c1-29-18-15-25-11-13-28(14-12-25)24(22-5-3-2-4-6-22)21-26-9-7-23(8-10-26)27-16-19-30-20-17-27/h2-6,23-24H,7-21H2,1H3
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| InChIKey |
ZHVUMGJMAOMQQU-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