General Information of the Compound
| Compound ID |
CP0523798
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| Compound Name |
1-ethyl-3-(phenylsulfonyl)-5-(piperazin-1-yl)-1H-indazole
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| Structure |
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| Formula |
C19H22N4O2S
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| Molecular Weight |
370.478
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| Canonical SMILES |
CCn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C19H22N4O2S/c1-2-23-18-9-8-15(22-12-10-20-11-13-22)14-17(18)19(21-23)26(24,25)16-6-4-3-5-7-16/h3-9,14,20H,2,10-13H2,1H3
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| InChIKey |
WWXQEIHDDCOFPN-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