General Information of the Compound
| Compound ID |
CP0549541
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| Compound Name |
N-[[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl]-N-phenylpropanamide
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| Structure |
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| Formula |
C21H33N3O
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| Molecular Weight |
343.515
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| Canonical SMILES |
CCC(=O)N(CC1(CCCCC1)N1CCN(C)CC1)c1ccccc1
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| InChI |
InChI=1S/C21H33N3O/c1-3-20(25)24(19-10-6-4-7-11-19)18-21(12-8-5-9-13-21)23-16-14-22(2)15-17-23/h4,6-7,10-11H,3,5,8-9,12-18H2,1-2H3
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| InChIKey |
JHOUTKHANFQIQK-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