General Information of the Compound
| Compound ID |
CP0474549
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| Compound Name |
4-amino-5-chloro-N-[1-(2-hydroxyethyl)piperidin-4-yl]-2-methoxybenzamide
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| Structure |
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| Formula |
C15H22ClN3O3
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| Molecular Weight |
327.812
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| Canonical SMILES |
COc1cc(N)c(Cl)cc1C(=O)NC1CCN(CCO)CC1
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| InChI |
InChI=1S/C15H22ClN3O3/c1-22-14-9-13(17)12(16)8-11(14)15(21)18-10-2-4-19(5-3-10)6-7-20/h8-10,20H,2-7,17H2,1H3,(H,18,21)
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| InChIKey |
BGUPBAJOPHUCTR-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