General Information of the Compound
| Compound ID |
CP0469261
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| Compound Name |
1-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]azetidine-3-carboxylic acid
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| Structure |
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| Formula |
C18H18FNO3
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| Molecular Weight |
315.344
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| Canonical SMILES |
OC(=O)C1CN(Cc2ccc(OCc3ccc(F)cc3)cc2)C1
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| InChI |
InChI=1S/C18H18FNO3/c19-16-5-1-14(2-6-16)12-23-17-7-3-13(4-8-17)9-20-10-15(11-20)18(21)22/h1-8,15H,9-12H2,(H,21,22)
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| InChIKey |
OFPIQTMYKZMOME-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