General Information of the Compound
| Compound ID |
CP0504765
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| Compound Name |
2-methyl-N-[1-[3-(3-oxo-1,4-benzoxazin-4-yl)propyl]piperidin-4-yl]propanamide
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| Structure |
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| Formula |
C20H29N3O3
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| Molecular Weight |
359.47
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| Canonical SMILES |
CC(C)C(=O)NC1CCN(CCCN2C(=O)COc3ccccc23)CC1
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| InChI |
InChI=1S/C20H29N3O3/c1-15(2)20(25)21-16-8-12-22(13-9-16)10-5-11-23-17-6-3-4-7-18(17)26-14-19(23)24/h3-4,6-7,15-16H,5,8-14H2,1-2H3,(H,21,25)
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| InChIKey |
GIOXUGQDHRDESE-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