General Information of the Compound
| Compound ID |
CP0961683
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| Compound Name |
N,N-diethyl-1-(2-(4-(2-methoxyethyl)piperazin-1-yl)-2-phenylethyl)piperidin-4-amine
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| Structure |
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| Formula |
C24H42N4O
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| Molecular Weight |
402.627
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| Canonical SMILES |
CCN(CC)C1CCN(CC(c2ccccc2)N2CCN(CCOC)CC2)CC1
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| InChI |
InChI=1S/C24H42N4O/c1-4-27(5-2)23-11-13-26(14-12-23)21-24(22-9-7-6-8-10-22)28-17-15-25(16-18-28)19-20-29-3/h6-10,23-24H,4-5,11-21H2,1-3H3
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| InChIKey |
BWSHIPXBSXIXGQ-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