General Information of the Compound
| Compound ID |
CP0165162
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| Compound Name |
1-({4-[6-Methyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-1-yl]phenyl}methyl)-2-pyrrolidinone
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| Structure |
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| Formula |
C19H21F3N4O
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| Molecular Weight |
378.398
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| Canonical SMILES |
CN1CCc2c(C1)n(nc2C(F)(F)F)-c1ccc(CN2CCCC2=O)cc1
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| InChI |
InChI=1S/C19H21F3N4O/c1-24-10-8-15-16(12-24)26(23-18(15)19(20,21)22)14-6-4-13(5-7-14)11-25-9-2-3-17(25)27/h4-7H,2-3,8-12H2,1H3
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| InChIKey |
ZIPGXLPLMWBESM-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