General Information of the Compound
| Compound ID |
CP0394202
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| Compound Name |
2-{5-fluoro-1'-[(2-methoxyethoxy)methyl]-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-2,2',5'-trione}acetic acid
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| Structure |
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| Formula |
C17H17FN2O7
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| Molecular Weight |
380.328
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| Canonical SMILES |
COCCOCN1C(=O)CC2(C1=O)C(=O)N(CC(O)=O)c1ccc(F)cc21
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| InChI |
InChI=1S/C17H17FN2O7/c1-26-4-5-27-9-20-13(21)7-17(16(20)25)11-6-10(18)2-3-12(11)19(15(17)24)8-14(22)23/h2-3,6H,4-5,7-9H2,1H3,(H,22,23)
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| InChIKey |
PYTDDVUQGRSZEA-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