General Information of the Compound
| Compound ID |
CP0954930
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| Compound Name |
1-Butyl-4-{1-phenyl-2-[4-(piperidin-1-yl)piperidin-1-yl]ethyl}piperazine
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| Structure |
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| Formula |
C26H44N4
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| Molecular Weight |
412.666
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| Canonical SMILES |
CCCCN1CCN(C(CN2CCC(N3CCCCC3)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C26H44N4/c1-2-3-14-27-19-21-30(22-20-27)26(24-10-6-4-7-11-24)23-28-17-12-25(13-18-28)29-15-8-5-9-16-29/h4,6-7,10-11,25-26H,2-3,5,8-9,12-23H2,1H3
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| InChIKey |
FMQYLMODRVYWBF-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