General Information of the Compound
| Compound ID |
CP0549435
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| Compound Name |
4-cyclopropyl-N-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
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| Structure |
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| Formula |
C17H18N2OS
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| Molecular Weight |
298.411
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| Canonical SMILES |
O=C(Nc1ccccc1)N1CCc2sccc2C1C1CC1
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| InChI |
InChI=1S/C17H18N2OS/c20-17(18-13-4-2-1-3-5-13)19-10-8-15-14(9-11-21-15)16(19)12-6-7-12/h1-5,9,11-12,16H,6-8,10H2,(H,18,20)
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| InChIKey |
QXKHHDZVPSGWAX-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