General Information of the Compound
| Compound ID |
CP0522156
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| Compound Name |
3-(4-methoxyphenylsulfonyl)-6-(piperazin-1-yl)-1H-indazole
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| Structure |
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| Formula |
C18H20N4O3S
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| Molecular Weight |
372.45
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| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)c1n[nH]c2cc(ccc12)N1CCNCC1
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| InChI |
InChI=1S/C18H20N4O3S/c1-25-14-3-5-15(6-4-14)26(23,24)18-16-7-2-13(12-17(16)20-21-18)22-10-8-19-9-11-22/h2-7,12,19H,8-11H2,1H3,(H,20,21)
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| InChIKey |
OLZQQVBWGYEYMU-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