General Information of the Compound
| Compound ID |
CP0565126
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| Compound Name |
1-(3-chloro-4-methoxyphenyl)-3-(6-cyano-3,4-dihydro-2H-chromen-3-yl)urea
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| Formula |
C18H16ClN3O3
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| Molecular Weight |
357.797
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| Canonical SMILES |
COc1ccc(NC(=O)NC2COc3ccc(cc3C2)C#N)cc1Cl
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| InChI |
InChI=1S/C18H16ClN3O3/c1-24-17-5-3-13(8-15(17)19)21-18(23)22-14-7-12-6-11(9-20)2-4-16(12)25-10-14/h2-6,8,14H,7,10H2,1H3,(H2,21,22,23)
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| InChIKey |
GZVJHLXSCZLGPC-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