General Information of the Compound
| Compound ID |
CP0372734
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| Compound Name |
1-(1-acetylpiperidin-4-yl)-3-[1-(3,5-difluorophenyl)piperidin-4-yl]-1-methylurea
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| Structure |
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| Formula |
C20H28F2N4O2
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| Molecular Weight |
394.466
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| Canonical SMILES |
CN(C1CCN(CC1)C(C)=O)C(=O)NC1CCN(CC1)c1cc(F)cc(F)c1
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| InChI |
InChI=1S/C20H28F2N4O2/c1-14(27)25-9-5-18(6-10-25)24(2)20(28)23-17-3-7-26(8-4-17)19-12-15(21)11-16(22)13-19/h11-13,17-18H,3-10H2,1-2H3,(H,23,28)
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| InChIKey |
PRNXQDSSMMGBCA-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