General Information of the Compound
| Compound ID |
CP0499562
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| Compound Name |
6-ethyl-N-[1-(2-hydroxyacetyl)piperidin-4-yl]-3-methoxy-1-methyl-4-oxo-5-phenacylpyrrolo[3,2-c]pyridine-2-carboxamide
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| Structure |
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| Formula |
C27H32N4O6
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| Molecular Weight |
508.575
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| Canonical SMILES |
CCc1cc2n(C)c(C(=O)NC3CCN(CC3)C(=O)CO)c(OC)c2c(=O)n1CC(=O)c1ccccc1
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| InChI |
InChI=1S/C27H32N4O6/c1-4-19-14-20-23(27(36)31(19)15-21(33)17-8-6-5-7-9-17)25(37-3)24(29(20)2)26(35)28-18-10-12-30(13-11-18)22(34)16-32/h5-9,14,18,32H,4,10-13,15-16H2,1-3H3,(H,28,35)
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| InChIKey |
XNWXDOREQLTFFG-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