General Information of the Compound
| Compound ID |
CP0537541
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| Compound Name |
N-[3-(dipropylamino)-5-(trifluoromethyl)phenyl]thiophene-2-carboxamide
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| Structure |
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| Formula |
C18H21F3N2OS
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| Molecular Weight |
370.44
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| Canonical SMILES |
CCCN(CCC)c1cc(NC(=O)c2cccs2)cc(c1)C(F)(F)F
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| InChI |
InChI=1S/C18H21F3N2OS/c1-3-7-23(8-4-2)15-11-13(18(19,20)21)10-14(12-15)22-17(24)16-6-5-9-25-16/h5-6,9-12H,3-4,7-8H2,1-2H3,(H,22,24)
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| InChIKey |
CKOFIJSHLRUTLE-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