General Information of the Compound
| Compound ID |
CP0436090
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| Compound Name |
5-(3-fluorophenylsulfonyl)-3-(1-methylpiperidin-4-yl)-1H-indazole
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| Structure |
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| Formula |
C19H20FN3O2S
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| Molecular Weight |
373.453
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| Canonical SMILES |
CN1CCC(CC1)c1n[nH]c2ccc(cc12)S(=O)(=O)c1cccc(F)c1
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| InChI |
InChI=1S/C19H20FN3O2S/c1-23-9-7-13(8-10-23)19-17-12-16(5-6-18(17)21-22-19)26(24,25)15-4-2-3-14(20)11-15/h2-6,11-13H,7-10H2,1H3,(H,21,22)
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| InChIKey |
YCKHQZAJTTWVSE-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