General Information of the Compound
| Compound ID |
CP0577776
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| Compound Name |
US8987473, 75
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| Structure |
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| Formula |
C19H21NO2
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| Molecular Weight |
295.382
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| Canonical SMILES |
Cc1cccc(C)c1CN1CCc2ccc(CC(O)=O)cc12
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| InChI |
InChI=1S/C19H21NO2/c1-13-4-3-5-14(2)17(13)12-20-9-8-16-7-6-15(10-18(16)20)11-19(21)22/h3-7,10H,8-9,11-12H2,1-2H3,(H,21,22)
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| InChIKey |
LWMWFNZVGKSTIH-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