General Information of the Compound
| Compound ID |
CP0411394
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| Compound Name |
1-(3,3-diphenylpropyl)-3-(4-methoxy-6-methylpyrimidin-2-yl)-1-(2-morpholin-4-ylethyl)urea
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| Structure |
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| Formula |
C28H35N5O3
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| Molecular Weight |
489.62
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| Canonical SMILES |
COc1cc(C)nc(NC(=O)N(CCC(c2ccccc2)c2ccccc2)CCN2CCOCC2)n1
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| InChI |
InChI=1S/C28H35N5O3/c1-22-21-26(35-2)30-27(29-22)31-28(34)33(16-15-32-17-19-36-20-18-32)14-13-25(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-12,21,25H,13-20H2,1-2H3,(H,29,30,31,34)
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| InChIKey |
KLPWRARQXSFKDK-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