General Information of the Compound
| Compound ID |
CP0349695
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| Compound Name |
US10562854, No. A18
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| Structure |
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| Formula |
C20H26N2O3
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| Molecular Weight |
342.439
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| Canonical SMILES |
OCc1ccccc1Cn1ccc(CN2CCCCCC2)c(O)c1=O
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| InChI |
InChI=1S/C20H26N2O3/c23-15-18-8-4-3-7-16(18)14-22-12-9-17(19(24)20(22)25)13-21-10-5-1-2-6-11-21/h3-4,7-9,12,23-24H,1-2,5-6,10-11,13-15H2
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| InChIKey |
SEDQAFVMDOBVEF-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