General Information of the Compound
| Compound ID |
CP0261905
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| Compound Name |
2-(1-(4-(piperidin-1-yl)butyl)-3-(2-(piperidin-1-yl)ethyl)imidazolidin-2-ylidene)malononitrile
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| Structure |
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| Formula |
C22H36N6
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| Molecular Weight |
384.572
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| Canonical SMILES |
N#CC(C#N)=C1N(CCCCN2CCCCC2)CCN1CCN1CCCCC1
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| InChI |
InChI=1S/C22H36N6/c23-19-21(20-24)22-27(14-8-7-13-25-9-3-1-4-10-25)17-18-28(22)16-15-26-11-5-2-6-12-26/h1-18H2
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| InChIKey |
JUQMYGBMXZMRHX-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