General Information of the Compound
| Compound ID |
CP0494267
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| Compound Name |
1-[4-[[(5,6-diphenylfuro[2,3-d]pyrimidin-4-yl)amino]methyl]phenyl]-3-phenylurea
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| Structure |
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| Formula |
C32H25N5O2
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| Molecular Weight |
511.585
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| Canonical SMILES |
O=C(Nc1ccccc1)Nc1ccc(CNc2ncnc3oc(c(-c4ccccc4)c23)-c2ccccc2)cc1
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| InChI |
InChI=1S/C32H25N5O2/c38-32(36-25-14-8-3-9-15-25)37-26-18-16-22(17-19-26)20-33-30-28-27(23-10-4-1-5-11-23)29(24-12-6-2-7-13-24)39-31(28)35-21-34-30/h1-19,21H,20H2,(H,33,34,35)(H2,36,37,38)
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| InChIKey |
ORDJHYDDTQFOBO-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