General Information of the Compound
| Compound ID |
CP0257820
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| Compound Name |
US10239843, Example 2
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| Structure |
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| Formula |
C14H17N3O4S
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| Molecular Weight |
323.374
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| Canonical SMILES |
Cn1c2ccc(cc2c(=O)n(C)c1=O)S(=O)(=O)NC1(C)CC1
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| InChI |
InChI=1S/C14H17N3O4S/c1-14(6-7-14)15-22(20,21)9-4-5-11-10(8-9)12(18)17(3)13(19)16(11)2/h4-5,8,15H,6-7H2,1-3H3
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| InChIKey |
GQYWMELDXMRFKZ-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