General Information of the Compound
| Compound ID |
CP0505378
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| Compound Name |
3-(2-Chlorophenylsulfonyl)-5-(4-methylpiperazin-1-yl)-1H-indazole
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| Structure |
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| Formula |
C18H19ClN4O2S
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| Molecular Weight |
390.896
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| Canonical SMILES |
CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1ccccc1Cl
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| InChI |
InChI=1S/C18H19ClN4O2S/c1-22-8-10-23(11-9-22)13-6-7-16-14(12-13)18(21-20-16)26(24,25)17-5-3-2-4-15(17)19/h2-7,12H,8-11H2,1H3,(H,20,21)
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| InChIKey |
VRVOIROEETWTTF-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