General Information of the Compound
| Compound ID |
CP0418024
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| Compound Name |
2-[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]-N-(cyclohexylcarbamoyl)ethanamide
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| Structure |
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| Formula |
C13H16Cl2N4O3
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| Molecular Weight |
347.202
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| Canonical SMILES |
Clc1cnn(CC(=O)NC(=O)NC2CCCCC2)c(=O)c1Cl
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| InChI |
InChI=1S/C13H16Cl2N4O3/c14-9-6-16-19(12(21)11(9)15)7-10(20)18-13(22)17-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H2,17,18,20,22)
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| InChIKey |
XEGXWYVGOCPKQD-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8