General Information of the Compound
| Compound ID |
CP0577491
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| Compound Name |
4-[3-(6-piperazin-1-ylpyridin-3-yl)-2-(quinolin-2-ylmethyl)imidazo[1,2-b]pyridazin-8-yl]morpholine
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| Structure |
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| Formula |
C29H30N8O
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| Molecular Weight |
506.614
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| Canonical SMILES |
C(c1nc2c(ccnn2c1-c1ccc(nc1)N1CCNCC1)N1CCOCC1)c1ccc2ccccc2n1
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| InChI |
InChI=1S/C29H30N8O/c1-2-4-24-21(3-1)5-7-23(33-24)19-25-28(22-6-8-27(31-20-22)36-13-11-30-12-14-36)37-29(34-25)26(9-10-32-37)35-15-17-38-18-16-35/h1-10,20,30H,11-19H2
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| InChIKey |
BAGYXTZKUJKQAR-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