General Information of the Compound
| Compound ID |
CP0001536
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| Compound Name |
2,5-diphenyl-N-[1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]-1,3-oxazole-4-carboxamide
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| Structure |
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| Formula |
C27H28N6O2
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| Molecular Weight |
468.561
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| Canonical SMILES |
CC(CN1CCN(CC1)c1ncccn1)NC(=O)c1nc(oc1-c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C27H28N6O2/c1-20(19-32-15-17-33(18-16-32)27-28-13-8-14-29-27)30-25(34)23-24(21-9-4-2-5-10-21)35-26(31-23)22-11-6-3-7-12-22/h2-14,20H,15-19H2,1H3,(H,30,34)
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| InChIKey |
CXDVKQCUJSASGN-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