General Information of the Compound
| Compound ID |
CP0456532
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| Compound Name |
4-[(4-chlorophenoxy)methyl]-N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]benzamide
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| Structure |
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| Formula |
C24H30ClN3O2
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| Molecular Weight |
427.976
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| Canonical SMILES |
CN1CCC(CC1)N1CCC(C1)NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C24H30ClN3O2/c1-27-13-11-22(12-14-27)28-15-10-21(16-28)26-24(29)19-4-2-18(3-5-19)17-30-23-8-6-20(25)7-9-23/h2-9,21-22H,10-17H2,1H3,(H,26,29)
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| InChIKey |
JUQPOKSQDHYBAJ-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