General Information of the Compound
| Compound ID |
CP0478156
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| Compound Name |
4-[5-fluoro-1'-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-2,2',5'-trione]butanoic acid
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| Structure |
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| Formula |
C18H17FN2O5
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| Molecular Weight |
360.341
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| Canonical SMILES |
OC(=O)CCCN1C(=O)C2(CC(=O)N(CC=C)C2=O)c2cc(F)ccc12
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| InChI |
InChI=1S/C18H17FN2O5/c1-2-7-21-14(22)10-18(17(21)26)12-9-11(19)5-6-13(12)20(16(18)25)8-3-4-15(23)24/h2,5-6,9H,1,3-4,7-8,10H2,(H,23,24)
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| InChIKey |
UPVDJCOHQYEWCL-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