General Information of the Compound
| Compound ID |
CP0431325
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| Compound Name |
Biphenyl-4-sulfonic acid [1-(2-diethylamino-ethyl)-1H-indol-5-yl]-amide
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| Structure |
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| Formula |
C26H29N3O2S
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| Molecular Weight |
447.604
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| Canonical SMILES |
CCN(CC)CCn1ccc2cc(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)ccc12
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| InChI |
InChI=1S/C26H29N3O2S/c1-3-28(4-2)18-19-29-17-16-23-20-24(12-15-26(23)29)27-32(30,31)25-13-10-22(11-14-25)21-8-6-5-7-9-21/h5-17,20,27H,3-4,18-19H2,1-2H3
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| InChIKey |
IHTCWFQJHVITAM-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