General Information of the Compound
| Compound ID |
CP0451109
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| Compound Name |
N-[1-(5-fluoropyrimidin-2-yl)azetidin-3-yl]-2,4-dimethylquinoline-6-carboxamide
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| Structure |
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| Formula |
C19H18FN5O
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| Molecular Weight |
351.385
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| Canonical SMILES |
Cc1cc(C)c2cc(ccc2n1)C(=O)NC1CN(C1)c1ncc(F)cn1
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| InChI |
InChI=1S/C19H18FN5O/c1-11-5-12(2)23-17-4-3-13(6-16(11)17)18(26)24-15-9-25(10-15)19-21-7-14(20)8-22-19/h3-8,15H,9-10H2,1-2H3,(H,24,26)
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| InChIKey |
ZFXMBAUJTJQGPV-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