General Information of the Compound
| Compound ID |
CP0206985
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| Compound Name |
N-ethyl-5-methyl-N-(thiophen-2-ylmethyl)-1-benzothiophene-2-carboxamide
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| Structure |
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| Formula |
C17H17NOS2
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| Molecular Weight |
315.463
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| Canonical SMILES |
CCN(Cc1cccs1)C(=O)c1cc2cc(C)ccc2s1
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| InChI |
InChI=1S/C17H17NOS2/c1-3-18(11-14-5-4-8-20-14)17(19)16-10-13-9-12(2)6-7-15(13)21-16/h4-10H,3,11H2,1-2H3
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| InChIKey |
UJKMLVPJRKHPNI-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