General Information of the Compound
| Compound ID |
CP0490061
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| Compound Name |
5-Chloro-naphthalene-1-sulfonic acid [3-(2-diethylamino-ethyl)-1H-indol-5-yl]-amide
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| Structure |
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| Formula |
C24H26ClN3O2S
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| Molecular Weight |
456.011
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| Canonical SMILES |
CCN(CC)CCc1c[nH]c2ccc(NS(=O)(=O)c3cccc4c(Cl)cccc34)cc12
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| InChI |
InChI=1S/C24H26ClN3O2S/c1-3-28(4-2)14-13-17-16-26-23-12-11-18(15-21(17)23)27-31(29,30)24-10-6-7-19-20(24)8-5-9-22(19)25/h5-12,15-16,26-27H,3-4,13-14H2,1-2H3
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| InChIKey |
VBNSQPAQKREKCT-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