General Information of the Compound
| Compound ID |
CP0486990
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| Compound Name |
N-[1-[2-(2-methylsulfanylphenoxy)ethyl]piperidin-4-yl]thiophene-2-carboxamide
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| Structure |
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| Formula |
C19H24N2O2S2
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| Molecular Weight |
376.547
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| Canonical SMILES |
CSc1ccccc1OCCN1CCC(CC1)NC(=O)c1cccs1
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| InChI |
InChI=1S/C19H24N2O2S2/c1-24-17-6-3-2-5-16(17)23-13-12-21-10-8-15(9-11-21)20-19(22)18-7-4-14-25-18/h2-7,14-15H,8-13H2,1H3,(H,20,22)
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| InChIKey |
MQEBSURGECYFIP-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