General Information of the Compound
| Compound ID |
CP0398138
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| Compound Name |
(E)-N-[(2R,3R)-1-(4-fluorophenyl)-2-(4-hydroxyphenyl)-4-oxoazetidin-3-yl]-3-phenylprop-2-enamide
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| Structure |
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| Formula |
C24H19FN2O3
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| Molecular Weight |
402.425
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| Canonical SMILES |
Oc1ccc(cc1)[C@@H]1[C@@H](NC(=O)\C=C\c2ccccc2)C(=O)N1c1ccc(F)cc1
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| InChI |
InChI=1S/C24H19FN2O3/c25-18-9-11-19(12-10-18)27-23(17-7-13-20(28)14-8-17)22(24(27)30)26-21(29)15-6-16-4-2-1-3-5-16/h1-15,22-23,28H,(H,26,29)/b15-6+/t22-,23-/m1/s1
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| InChIKey |
TVKCKDGDWWQAQT-DAUDZKOSSA-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