General Information of the Compound
| Compound ID |
CP0572268
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| Compound Name |
US10167273, Example 33
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| Structure |
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| Formula |
C20H23N3O3S
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| Molecular Weight |
385.489
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| Canonical SMILES |
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)Oc1ccc2ccccc2c1
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| InChI |
InChI=1S/C20H23N3O3S/c1-14-20(15(2)22-21-14)27(24,25)23-11-9-18(10-12-23)26-19-8-7-16-5-3-4-6-17(16)13-19/h3-8,13,18H,9-12H2,1-2H3,(H,21,22)
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| InChIKey |
AXYFHHUNIHMJGQ-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