General Information of the Compound
| Compound ID |
CP0313637
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| Compound Name |
N-ethyl-3-(4-methylphenyl)-N-(thiophen-2-ylmethyl)propanamide
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| Structure |
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| Formula |
C17H21NOS
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| Molecular Weight |
287.428
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| Canonical SMILES |
CCN(Cc1cccs1)C(=O)CCc1ccc(C)cc1
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| InChI |
InChI=1S/C17H21NOS/c1-3-18(13-16-5-4-12-20-16)17(19)11-10-15-8-6-14(2)7-9-15/h4-9,12H,3,10-11,13H2,1-2H3
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| InChIKey |
JZNKOLIQDABMIX-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