General Information of the Compound
| Compound ID |
CP0486991
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| Compound Name |
3-fluoro-N-[1-[2-(3-phenylphenoxy)ethyl]pyrrolidin-3-yl]benzamide
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| Structure |
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| Formula |
C25H25FN2O2
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| Molecular Weight |
404.485
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| Canonical SMILES |
Fc1cccc(c1)C(=O)NC1CCN(CCOc2cccc(c2)-c2ccccc2)C1
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| InChI |
InChI=1S/C25H25FN2O2/c26-22-10-4-9-21(16-22)25(29)27-23-12-13-28(18-23)14-15-30-24-11-5-8-20(17-24)19-6-2-1-3-7-19/h1-11,16-17,23H,12-15,18H2,(H,27,29)
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| InChIKey |
CLTQTINJWOQTJV-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