General Information of the Compound
| Compound ID |
CP0144483
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| Compound Name |
1-(3,4-difluorophenethyl)-N-(4-chlorophenyl)-1H-pyrazole-5-carboxamide
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| Structure |
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| Formula |
C18H14ClF2N3O
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| Molecular Weight |
361.779
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| Canonical SMILES |
Fc1ccc(CCn2nccc2C(=O)Nc2ccc(Cl)cc2)cc1F
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| InChI |
InChI=1S/C18H14ClF2N3O/c19-13-2-4-14(5-3-13)23-18(25)17-7-9-22-24(17)10-8-12-1-6-15(20)16(21)11-12/h1-7,9,11H,8,10H2,(H,23,25)
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| InChIKey |
NYXWBCCABNTOHP-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