General Information of the Compound
| Compound ID |
CP0559953
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| Compound Name |
2-piperidin-1-yl-N-[4-(1-propan-2-ylpiperidin-4-yl)oxyphenyl]acetamide;dihydrochloride
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| Structure |
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| Formula |
C21H35Cl2N3O2
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| Molecular Weight |
432.436
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| Canonical SMILES |
Cl.Cl.CC(C)N1CCC(CC1)Oc1ccc(NC(=O)CN2CCCCC2)cc1
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| InChI |
InChI=1S/C21H33N3O2.2ClH/c1-17(2)24-14-10-20(11-15-24)26-19-8-6-18(7-9-19)22-21(25)16-23-12-4-3-5-13-23;;/h6-9,17,20H,3-5,10-16H2,1-2H3,(H,22,25);2*1H
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| InChIKey |
WCEOTRJTRSLKLY-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