General Information of the Compound
| Compound ID |
CP0438461
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| Compound Name |
3,4-dimethyl-N-[1-[5-(trifluoromethyl)pyrimidin-2-yl]azetidin-3-yl]cinnoline-6-carboxamide
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| Structure |
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| Formula |
C19H17F3N6O
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| Molecular Weight |
402.38
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| Canonical SMILES |
Cc1nnc2ccc(cc2c1C)C(=O)NC1CN(C1)c1ncc(cn1)C(F)(F)F
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| InChI |
InChI=1S/C19H17F3N6O/c1-10-11(2)26-27-16-4-3-12(5-15(10)16)17(29)25-14-8-28(9-14)18-23-6-13(7-24-18)19(20,21)22/h3-7,14H,8-9H2,1-2H3,(H,25,29)
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| InChIKey |
PFMWWDBQLSJPIW-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