General Information of the Compound
| Compound ID |
CP0432945
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| Compound Name |
4-(4-chloro-2-methoxyphenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-piperazinehexanamide
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| Structure |
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| Formula |
C27H36ClN3O2
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| Molecular Weight |
470.057
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| Canonical SMILES |
COc1cc(Cl)ccc1N1CCN(CCCCCC(=O)NC2CCCc3ccccc23)CC1
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| InChI |
InChI=1S/C27H36ClN3O2/c1-33-26-20-22(28)13-14-25(26)31-18-16-30(17-19-31)15-6-2-3-12-27(32)29-24-11-7-9-21-8-4-5-10-23(21)24/h4-5,8,10,13-14,20,24H,2-3,6-7,9,11-12,15-19H2,1H3,(H,29,32)
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| InChIKey |
STJAWCYYILSFEK-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