General Information of the Compound
| Compound ID |
CP0017443
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| Compound Name |
N-[3-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]-2H-indazol-5-yl]methanesulfonamide
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| Structure |
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| Formula |
C19H19N5O2S
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| Molecular Weight |
381.461
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| Canonical SMILES |
Cn1cc(cn1)-c1ccc(Cc2n[nH]c3ccc(NS(C)(=O)=O)cc23)cc1
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| InChI |
InChI=1S/C19H19N5O2S/c1-24-12-15(11-20-24)14-5-3-13(4-6-14)9-19-17-10-16(23-27(2,25)26)7-8-18(17)21-22-19/h3-8,10-12,23H,9H2,1-2H3,(H,21,22)
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| InChIKey |
DDMBDFURJHEOSG-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