General Information of the Compound
| Compound ID |
CP0546341
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| Compound Name |
3-[1-[2-(2-oxopyridin-1-yl)ethyl]piperidin-4-yl]-1H-benzimidazol-2-one
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| Structure |
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| Formula |
C19H22N4O2
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| Molecular Weight |
338.411
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| Canonical SMILES |
O=c1[nH]c2ccccc2n1C1CCN(CCn2ccccc2=O)CC1
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| InChI |
InChI=1S/C19H22N4O2/c24-18-7-3-4-10-22(18)14-13-21-11-8-15(9-12-21)23-17-6-2-1-5-16(17)20-19(23)25/h1-7,10,15H,8-9,11-14H2,(H,20,25)
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| InChIKey |
UCYJQHLDEQRRRO-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
Protein ID: PT01943, Phospholipase D1
Protein ID: PT01153, Phospholipase D2