General Information of the Compound
| Compound ID |
CP0399033
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| Compound Name |
N-[(3S)-5-methyl-4-oxo-2,3-dihydro-1,5-benzoxazepin-3-yl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C18H21N3O4
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| Molecular Weight |
343.383
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| Canonical SMILES |
CC(C)Cc1cc(no1)C(=O)N[C@H]1COc2ccccc2N(C)C1=O
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| InChI |
InChI=1S/C18H21N3O4/c1-11(2)8-12-9-13(20-25-12)17(22)19-14-10-24-16-7-5-4-6-15(16)21(3)18(14)23/h4-7,9,11,14H,8,10H2,1-3H3,(H,19,22)/t14-/m0/s1
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| InChIKey |
BNFZELRXWKQQTE-AWEZNQCLSA-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