General Information of the Compound
| Compound ID |
CP0469984
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| Compound Name |
N-phenyl-2-[(2,2,2-trifluoroacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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| Structure |
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| Formula |
C17H15F3N2O2S
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| Molecular Weight |
368.38
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| Canonical SMILES |
FC(F)(F)C(=O)Nc1sc2CCCCc2c1C(=O)Nc1ccccc1
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| InChI |
InChI=1S/C17H15F3N2O2S/c18-17(19,20)16(24)22-15-13(11-8-4-5-9-12(11)25-15)14(23)21-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,21,23)(H,22,24)
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| InChIKey |
AZZPTDYIOUQIPN-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