General Information of the Compound
| Compound ID |
CP0535378
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| Compound Name |
N-[4-(1-cyclobutylpiperidin-4-yl)oxy-2-methoxyphenyl]-2-morpholin-4-ylacetamide
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| Structure |
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| Formula |
C22H33N3O4
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| Molecular Weight |
403.523
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| Canonical SMILES |
COc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCOCC1
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| InChI |
InChI=1S/C22H33N3O4/c1-27-21-15-19(29-18-7-9-25(10-8-18)17-3-2-4-17)5-6-20(21)23-22(26)16-24-11-13-28-14-12-24/h5-6,15,17-18H,2-4,7-14,16H2,1H3,(H,23,26)
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| InChIKey |
VMTIWEUCRSEFQS-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