General Information of the Compound
| Compound ID |
CP0149869
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| Compound Name |
4-dodecyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamide
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| Synonyms |
PHT 427
PHT-427
PHT427
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| Structure |
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| Formula |
C20H31N3O2S2
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| Molecular Weight |
409.621
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| Canonical SMILES |
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
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| InChI |
InChI=1S/C20H31N3O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-15-19(16-14-18)27(24,25)23-20-22-21-17-26-20/h13-17H,2-12H2,1H3,(H,22,23)
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| InChIKey |
BYWWNRBKPCPJMG-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
Clinical Information about the Compound