General Information of the Compound
| Compound ID |
CP0563024
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| Compound Name |
CHEMBL4533486
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| Formula |
C18H22FN3O3
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| Molecular Weight |
347.39
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| Canonical SMILES |
CCCCCCCN\C=C1\C(O)=NC(=O)N(C1=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C18H22FN3O3/c1-2-3-4-5-6-11-20-12-15-16(23)21-18(25)22(17(15)24)14-9-7-13(19)8-10-14/h7-10,12,20H,2-6,11H2,1H3,(H,21,23,25)/b15-12-
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| InChIKey |
USOMPPYQFBRRDB-QINSGFPZSA-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