General Information of the Compound
| Compound ID |
CP0512643
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| Compound Name |
US9012651, 201
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| Structure |
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| Formula |
C19H31FN2O
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| Molecular Weight |
322.468
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| Canonical SMILES |
CCC1CCC(CC1)c1ccc(F)c(CN[C@@H](CO)C(C)C)n1
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| InChI |
InChI=1S/C19H31FN2O/c1-4-14-5-7-15(8-6-14)17-10-9-16(20)18(22-17)11-21-19(12-23)13(2)3/h9-10,13-15,19,21,23H,4-8,11-12H2,1-3H3/t14?,15?,19-/m0/s1
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| InChIKey |
NHXMXVUJQKBQMO-ZOJXTTQQSA-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