General Information of the Compound
| Compound ID |
CP0951384
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| Compound Name |
(S)-1-(1-(2-(2-oxopyridin-1(2H)-yl)propyl)piperidin-4-yl)-1,3-dihydro-2Hbenzo[d]imidazol-2-one
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| Structure |
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| Formula |
C20H24N4O2
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| Molecular Weight |
352.438
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| Canonical SMILES |
C[C@@H](CN1CCC(n2c(=O)[nH]c3ccccc32)CC1)n1ccccc1=O
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| InChI |
InChI=1S/C20H24N4O2/c1-15(23-11-5-4-8-19(23)25)14-22-12-9-16(10-13-22)24-18-7-3-2-6-17(18)21-20(24)26/h2-8,11,15-16H,9-10,12-14H2,1H3,(H,21,26)/t15-/m0/s1
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| InChIKey |
OIYNZQSCZWPDMW-HNNXBMFYSA-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