General Information of the Compound
| Compound ID |
CP0081733
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| Compound Name |
1-[(2S)-2,3-dihydro-1-benzofuran-2-yl]-N-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-methylmethanamine
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| Structure |
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| Formula |
C19H20N2O3
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| Molecular Weight |
324.38
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| Canonical SMILES |
CN(C[C@@H]1Cc2ccccc2O1)Cc1nc(oc1C)-c1ccco1
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| InChI |
InChI=1S/C19H20N2O3/c1-13-16(20-19(23-13)18-8-5-9-22-18)12-21(2)11-15-10-14-6-3-4-7-17(14)24-15/h3-9,15H,10-12H2,1-2H3/t15-/m0/s1
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| InChIKey |
NVGPCGUJNQAMPN-HNNXBMFYSA-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