General Information of the Compound
| Compound ID |
CP0958092
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| Compound Name |
N-(1-(2-(4-(2-methoxyethyl)piperazin-1-yl)-2-phenylethyl)piperidin-4-yl)isobutyramide
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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(NC(=O)C(C)C)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C24H40N4O2/c1-20(2)24(29)25-22-9-11-27(12-10-22)19-23(21-7-5-4-6-8-21)28-15-13-26(14-16-28)17-18-30-3/h4-8,20,22-23H,9-19H2,1-3H3,(H,25,29)
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| InChIKey |
SEYFTNPUQPPIKT-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