General Information of the Compound
| Compound ID |
CP0526845
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| Compound Name |
6-fluoro-1-methyl-5-[2-piperidin-4-yl-7-(trifluoromethyl)indazol-5-yl]pyridin-2-one
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| Structure |
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| Formula |
C19H18F4N4O
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| Molecular Weight |
394.372
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| Canonical SMILES |
Cn1c(F)c(ccc1=O)-c1cc(c2nn(cc2c1)C1CCNCC1)C(F)(F)F
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| InChI |
InChI=1S/C19H18F4N4O/c1-26-16(28)3-2-14(18(26)20)11-8-12-10-27(13-4-6-24-7-5-13)25-17(12)15(9-11)19(21,22)23/h2-3,8-10,13,24H,4-7H2,1H3
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| InChIKey |
UITORJDEMKPKGW-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