General Information of the Compound
| Compound ID |
CP0575998
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| Compound Name |
N-[(3R)-1-[3-(4-cyanophenyl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl]pyrrolidin-3-yl]acetamide
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| Structure |
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| Formula |
C21H22N6O
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| Molecular Weight |
374.448
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| Canonical SMILES |
CC(=O)N[C@@H]1CCN(C1)c1cc(C)nn2c(c(C)nc12)-c1ccc(cc1)C#N
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| InChI |
InChI=1S/C21H22N6O/c1-13-10-19(26-9-8-18(12-26)24-15(3)28)21-23-14(2)20(27(21)25-13)17-6-4-16(11-22)5-7-17/h4-7,10,18H,8-9,12H2,1-3H3,(H,24,28)/t18-/m1/s1
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| InChIKey |
PUEYRBZLKINFOD-GOSISDBHSA-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