General Information of the Compound
| Compound ID |
CP0082731
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| Compound Name |
US10239843, Example 26
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| Structure |
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| Formula |
C17H24N4O4S
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| Molecular Weight |
380.47
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| Canonical SMILES |
CN(C)CCn1c2ccc(cc2c(=O)n(C)c1=O)S(=O)(=O)NC1(C)CC1
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| InChI |
InChI=1S/C17H24N4O4S/c1-17(7-8-17)18-26(24,25)12-5-6-14-13(11-12)15(22)20(4)16(23)21(14)10-9-19(2)3/h5-6,11,18H,7-10H2,1-4H3
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| InChIKey |
ZTCBWQMJJZDTPV-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