General Information of the Compound
| Compound ID |
CP0423345
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| Compound Name |
3-[1-[1-(2,4-dichlorophenyl)-6-methyl-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]-1H-imidazol-2-one
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| Structure |
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| Formula |
C20H16Cl2N6O
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| Molecular Weight |
427.295
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| Canonical SMILES |
Cc1cc(c2CCN(c2n1)c1ccc(Cl)cc1Cl)-n1ccc(n1)-n1cc[nH]c1=O
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| InChI |
InChI=1S/C20H16Cl2N6O/c1-12-10-17(28-8-5-18(25-28)27-9-6-23-20(27)29)14-4-7-26(19(14)24-12)16-3-2-13(21)11-15(16)22/h2-3,5-6,8-11H,4,7H2,1H3,(H,23,29)
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| InChIKey |
MTYWIVRPYVRRLR-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