General Information of the Compound
| Compound ID |
CP0540453
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| Compound Name |
1-[(2,3-difluorophenyl)methyl]-5-[[5-fluoro-2-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]methyl]pyridin-2-one
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| Structure |
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| Formula |
C28H26F3N3O2
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| Molecular Weight |
493.529
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| Canonical SMILES |
Cc1c(Cc2ccc(=O)n(Cc3cccc(F)c3F)c2)c2cc(F)ccc2n1CC(=O)N1CCCC1
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| InChI |
InChI=1S/C28H26F3N3O2/c1-18-22(13-19-7-10-26(35)33(15-19)16-20-5-4-6-24(30)28(20)31)23-14-21(29)8-9-25(23)34(18)17-27(36)32-11-2-3-12-32/h4-10,14-15H,2-3,11-13,16-17H2,1H3
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| InChIKey |
ORNGMCOHJPKCTI-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