General Information of the Compound
Compound ID |
CP0540359
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Compound Name |
1-(3,3-diphenylpropyl)-1-(2-morpholin-4-ylethyl)-3-[3-(1,3-oxazol-5-yl)phenyl]urea
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Structure |
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Formula |
C31H34N4O3
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Molecular Weight |
510.638
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Canonical SMILES |
O=C(Nc1cccc(c1)-c1cnco1)N(CCC(c1ccccc1)c1ccccc1)CCN1CCOCC1
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InChI |
InChI=1S/C31H34N4O3/c36-31(33-28-13-7-12-27(22-28)30-23-32-24-38-30)35(17-16-34-18-20-37-21-19-34)15-14-29(25-8-3-1-4-9-25)26-10-5-2-6-11-26/h1-13,22-24,29H,14-21H2,(H,33,36)
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InChIKey |
BAJDIRUBEAHUOL-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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