General Information of the Compound
| Compound ID |
CP0558034
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| Compound Name |
1-(cyclopropylmethyl)-5-methoxy-3-(2-phenylpyrazol-3-yl)pyridazin-4-one
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| Structure |
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| Formula |
C18H18N4O2
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| Molecular Weight |
322.368
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| Canonical SMILES |
COc1cn(CC2CC2)nc(-c2ccnn2-c2ccccc2)c1=O
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| InChI |
InChI=1S/C18H18N4O2/c1-24-16-12-21(11-13-7-8-13)20-17(18(16)23)15-9-10-19-22(15)14-5-3-2-4-6-14/h2-6,9-10,12-13H,7-8,11H2,1H3
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| InChIKey |
BMMJCDCWVKGXCA-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