General Information of the Compound
| Compound ID |
CP0415194
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| Compound Name |
(4-fluorophenyl)-[(8R)-8-methyl-3-(6-methylpyridin-2-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methanone
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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 |
C[C@H]1N(CCn2c1nnc2-c1cccc(C)n1)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C19H18FN5O/c1-12-4-3-5-16(21-12)18-23-22-17-13(2)24(10-11-25(17)18)19(26)14-6-8-15(20)9-7-14/h3-9,13H,10-11H2,1-2H3/t13-/m1/s1
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| InChIKey |
RVCUMGFNZZXOKY-CYBMUJFWSA-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