General Information of the Compound
| Compound ID |
CP0563900
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| Compound Name |
US9029381, 30
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| Structure |
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| Formula |
C19H27N3O3S
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| Molecular Weight |
377.51
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| Canonical SMILES |
CS(=O)(=O)Nc1cccc(c1)C1CC1C(=O)N1CCN(CC1)C1CCC1
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| InChI |
InChI=1S/C19H27N3O3S/c1-26(24,25)20-15-5-2-4-14(12-15)17-13-18(17)19(23)22-10-8-21(9-11-22)16-6-3-7-16/h2,4-5,12,16-18,20H,3,6-11,13H2,1H3
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| InChIKey |
DDAFIAIXGARHND-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