General Information of the Compound
| Compound ID |
CP0436008
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| Compound Name |
5-chloro-1-naphthalen-1-ylsulfonyl-4-piperazin-1-ylindole
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| Structure |
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| Formula |
C22H20ClN3O2S
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| Molecular Weight |
425.941
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| Canonical SMILES |
Clc1ccc2n(ccc2c1N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C22H20ClN3O2S/c23-19-8-9-20-18(22(19)25-14-11-24-12-15-25)10-13-26(20)29(27,28)21-7-3-5-16-4-1-2-6-17(16)21/h1-10,13,24H,11-12,14-15H2
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| InChIKey |
ZGXQWBKTMYXZPG-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