General Information of the Compound
| Compound ID |
CP0866308
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| Compound Name |
N-(4-chloro-2-(1H-pyrazole-3-carbonyl)phenyl)-3-fluoro-4-(4-methyltetrahydro-2H-pyran-4-yl)benzenesulfonamide
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| Structure |
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| Formula |
C22H21ClFN3O4S
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| Molecular Weight |
477.945
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| Canonical SMILES |
CC1(c2ccc(S(=O)(=O)Nc3ccc(Cl)cc3C(=O)c3cc[nH]n3)cc2F)CCOCC1
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| InChI |
InChI=1S/C22H21ClFN3O4S/c1-22(7-10-31-11-8-22)17-4-3-15(13-18(17)24)32(29,30)27-19-5-2-14(23)12-16(19)21(28)20-6-9-25-26-20/h2-6,9,12-13,27H,7-8,10-11H2,1H3,(H,25,26)
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| InChIKey |
SYPVLEFCVYUKGH-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