General Information of the Compound
| Compound ID |
CP0373100
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| Compound Name |
4-{5-fluoro-1'-methyl-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-2,2',5'-trione}butanoic acid
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| Structure |
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| Formula |
C16H15FN2O5
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| Molecular Weight |
334.303
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| Canonical SMILES |
CN1C(=O)CC2(C1=O)C(=O)N(CCCC(O)=O)c1ccc(F)cc21
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| InChI |
InChI=1S/C16H15FN2O5/c1-18-12(20)8-16(14(18)23)10-7-9(17)4-5-11(10)19(15(16)24)6-2-3-13(21)22/h4-5,7H,2-3,6,8H2,1H3,(H,21,22)
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| InChIKey |
HQTGOXIPSYMONJ-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