General Information of the Compound
| Compound ID |
CP0488807
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| Compound Name |
US9169224, 150
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| Structure |
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| Formula |
C18H18F2N4O3
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| Molecular Weight |
376.363
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| Canonical SMILES |
FC1(F)Oc2ccc(CN3CCN(CC3)C(=O)Nc3cccnc3)cc2O1
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| InChI |
InChI=1S/C18H18F2N4O3/c19-18(20)26-15-4-3-13(10-16(15)27-18)12-23-6-8-24(9-7-23)17(25)22-14-2-1-5-21-11-14/h1-5,10-11H,6-9,12H2,(H,22,25)
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| InChIKey |
RFSSDZNSBWBBLR-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