General Information of the Compound
| Compound ID |
CP0513103
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| Compound Name |
5-methyl-7-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]imidazo[1,5-b]pyridazine
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| Structure |
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| Formula |
C23H21N5
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| Molecular Weight |
367.456
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| Canonical SMILES |
Cc1nc(CCc2nc3cc(C)ccc3n2-c2ccccc2)n2ncccc12
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| InChI |
InChI=1S/C23H21N5/c1-16-10-11-21-19(15-16)26-22(27(21)18-7-4-3-5-8-18)12-13-23-25-17(2)20-9-6-14-24-28(20)23/h3-11,14-15H,12-13H2,1-2H3
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| InChIKey |
CBMGDCXJXDDPNS-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