General Information of the Compound
| Compound ID |
CP0938652
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| Compound Name |
(R)-N-(1-(3-(1H-Indol-6-yl)-2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl)acetamide
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| Structure |
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| Formula |
C22H24N6O
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| Molecular Weight |
388.475
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| Canonical SMILES |
CC(=O)N[C@@H]1CCN(c2cc(C)nn3c(-c4ccc5cc[nH]c5c4)c(C)nc23)C1
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| InChI |
InChI=1S/C22H24N6O/c1-13-10-20(27-9-7-18(12-27)25-15(3)29)22-24-14(2)21(28(22)26-13)17-5-4-16-6-8-23-19(16)11-17/h4-6,8,10-11,18,23H,7,9,12H2,1-3H3,(H,25,29)/t18-/m1/s1
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| InChIKey |
DWYFRZOOIYGQEB-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