General Information of the Compound
| Compound ID |
CP0545246
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| Compound Name |
US10174015, Compound 32
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| Structure |
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| Formula |
C16H21NO3
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| Molecular Weight |
275.348
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| Canonical SMILES |
Cc1cccc(CCCCCC(=O)N2CCOC2=O)c1
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| InChI |
InChI=1S/C16H21NO3/c1-13-6-5-8-14(12-13)7-3-2-4-9-15(18)17-10-11-20-16(17)19/h5-6,8,12H,2-4,7,9-11H2,1H3
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| InChIKey |
XZBIEPGIYUKCAC-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