General Information of the Compound
| Compound ID |
CP0550142
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| Compound Name |
N-[2-[(1,1-dimethyl-2,3-dihydroinden-5-yl)amino]-1-(4-methoxyphenyl)-2-oxoethyl]-N-methyl-6-oxo-1H-pyridine-3-carboxamide
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| Structure |
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| Formula |
C27H29N3O4
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| Molecular Weight |
459.546
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| Canonical SMILES |
COc1ccc(cc1)C(N(C)C(=O)c1ccc(=O)[nH]c1)C(=O)Nc1ccc2c(CCC2(C)C)c1
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| InChI |
InChI=1S/C27H29N3O4/c1-27(2)14-13-18-15-20(8-11-22(18)27)29-25(32)24(17-5-9-21(34-4)10-6-17)30(3)26(33)19-7-12-23(31)28-16-19/h5-12,15-16,24H,13-14H2,1-4H3,(H,28,31)(H,29,32)
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| InChIKey |
HBPLCOVCXZOVDN-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