General Information of the Compound
| Compound ID |
CP0481240
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| Compound Name |
N-[(3S)-5-methyl-4-oxo-2,3-dihydro-1,5-benzoxazepin-3-yl]-5-(piperidin-1-ylmethyl)-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C20H24N4O4
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| Molecular Weight |
384.436
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| Canonical SMILES |
CN1c2ccccc2OC[C@H](NC(=O)c2cc(CN3CCCCC3)on2)C1=O
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| InChI |
InChI=1S/C20H24N4O4/c1-23-17-7-3-4-8-18(17)27-13-16(20(23)26)21-19(25)15-11-14(28-22-15)12-24-9-5-2-6-10-24/h3-4,7-8,11,16H,2,5-6,9-10,12-13H2,1H3,(H,21,25)/t16-/m0/s1
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| InChIKey |
ZDSBJQYOCAGAGG-INIZCTEOSA-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