General Information of the Compound
| Compound ID |
CP0450490
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| Compound Name |
5-chloro-2-(9H-fluoren-9-yl)-4-(4-propoxyphenoxy)pyridazin-3-one
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| Structure |
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| Formula |
C26H21ClN2O3
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| Molecular Weight |
444.918
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| Canonical SMILES |
CCCOc1ccc(Oc2c(Cl)cnn(C3c4ccccc4-c4ccccc34)c2=O)cc1
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| InChI |
InChI=1S/C26H21ClN2O3/c1-2-15-31-17-11-13-18(14-12-17)32-25-23(27)16-28-29(26(25)30)24-21-9-5-3-7-19(21)20-8-4-6-10-22(20)24/h3-14,16,24H,2,15H2,1H3
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| InChIKey |
WWVZAKXBKMDHSV-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