General Information of the Compound
| Compound ID |
CP0049080
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| Compound Name |
7-{(R)-2-[(E)-3-Hydroxy-3-(5-trifluoromethyl-furan-2-yl)-propenyl]-5-oxo-pyrrolidin-1-yl}-heptanoic acid
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| Structure |
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| Formula |
C19H24F3NO5
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| Molecular Weight |
403.397
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| Canonical SMILES |
OC(\C=C\[C@H]1CCC(=O)N1CCCCCCC(O)=O)c1ccc(o1)C(F)(F)F
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| InChI |
InChI=1S/C19H24F3NO5/c20-19(21,22)16-10-9-15(28-16)14(24)8-6-13-7-11-17(25)23(13)12-4-2-1-3-5-18(26)27/h6,8-10,13-14,24H,1-5,7,11-12H2,(H,26,27)/b8-6+/t13-,14?/m0/s1
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| InChIKey |
OPSCHTQVFRPQFQ-PYYZMMIDSA-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