General Information of the Compound
| Compound ID |
CP0385538
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| Compound Name |
[4-[6-(4-methylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-2-yl]phenyl]-morpholin-4-ylmethanone
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| Structure |
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| Formula |
C27H29N7O2
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| Molecular Weight |
483.576
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| Canonical SMILES |
CN1CCN(CC1)c1ccc2nc(c(-c3ccncc3)n2n1)-c1ccc(cc1)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C27H29N7O2/c1-31-12-14-32(15-13-31)24-7-6-23-29-25(26(34(23)30-24)21-8-10-28-11-9-21)20-2-4-22(5-3-20)27(35)33-16-18-36-19-17-33/h2-11H,12-19H2,1H3
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| InChIKey |
PTFDQIBTFLXUAW-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