General Information of the Compound
| Compound ID |
CP0247951
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| Compound Name |
(E)-N-(4-[(4-Oxochroman-3-ylidene)methyl]phenyl)acetamide
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| Structure |
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| Formula |
C18H15NO3
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| Molecular Weight |
293.322
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| Canonical SMILES |
CC(=O)Nc1ccc(\C=C2/COc3ccccc3C2=O)cc1
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| InChI |
InChI=1S/C18H15NO3/c1-12(20)19-15-8-6-13(7-9-15)10-14-11-22-17-5-3-2-4-16(17)18(14)21/h2-10H,11H2,1H3,(H,19,20)/b14-10+
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| InChIKey |
YIOFKDNRFXPGIZ-GXDHUFHOSA-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
Protein ID: PT00918, Amine oxidase [flavin-containing] A
Protein ID: PT01362, Amine oxidase [flavin-containing] B