General Information of the Compound
| Compound ID |
CP0393702
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| Compound Name |
1-(2-bromophenyl)sulfonyl-5-methoxy-3-[(4-methylpiperazin-1-yl)methyl]indazole
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| Structure |
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| Formula |
C20H23BrN4O3S
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| Molecular Weight |
479.4
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| Canonical SMILES |
COc1ccc2n(nc(CN3CCN(C)CC3)c2c1)S(=O)(=O)c1ccccc1Br
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| InChI |
InChI=1S/C20H23BrN4O3S/c1-23-9-11-24(12-10-23)14-18-16-13-15(28-2)7-8-19(16)25(22-18)29(26,27)20-6-4-3-5-17(20)21/h3-8,13H,9-12,14H2,1-2H3
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| InChIKey |
FEPRIPFWMFBUDZ-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