General Information of the Compound
| Compound ID |
CP0450982
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| Compound Name |
2-(2-(2-bromophenoxy)ethyl)-6-(piperazin-1-yl)pyridazin-3(2H)-one
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| Structure |
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| Formula |
C16H19BrN4O2
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| Molecular Weight |
379.258
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| Canonical SMILES |
Brc1ccccc1OCCn1nc(ccc1=O)N1CCNCC1
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| InChI |
InChI=1S/C16H19BrN4O2/c17-13-3-1-2-4-14(13)23-12-11-21-16(22)6-5-15(19-21)20-9-7-18-8-10-20/h1-6,18H,7-12H2
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| InChIKey |
SVJQNKLYWBDGMG-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