General Information of the Compound
| Compound ID |
CP0535700
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| Compound Name |
N-[1-(3,4-difluorophenyl)azetidin-3-yl]-3,4-dimethylcinnoline-6-carboxamide
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| Structure |
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| Formula |
C20H18F2N4O
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| Molecular Weight |
368.387
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| Canonical SMILES |
Cc1nnc2ccc(cc2c1C)C(=O)NC1CN(C1)c1ccc(F)c(F)c1
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| InChI |
InChI=1S/C20H18F2N4O/c1-11-12(2)24-25-19-6-3-13(7-16(11)19)20(27)23-14-9-26(10-14)15-4-5-17(21)18(22)8-15/h3-8,14H,9-10H2,1-2H3,(H,23,27)
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| InChIKey |
OHCBGZOTHAVARJ-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