General Information of the Compound
| Compound ID |
CP0377851
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| Compound Name |
4-[2-(4-Chloro-phenyl)-2-(5-cyclopentyloxy-2-fluoro-4-methoxy-phenyl)-ethyl]-pyridine
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| Structure |
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| Formula |
C25H25ClFNO2
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| Molecular Weight |
425.931
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| Canonical SMILES |
COc1cc(F)c(cc1OC1CCCC1)C(Cc1ccncc1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C25H25ClFNO2/c1-29-24-16-23(27)22(15-25(24)30-20-4-2-3-5-20)21(14-17-10-12-28-13-11-17)18-6-8-19(26)9-7-18/h6-13,15-16,20-21H,2-5,14H2,1H3
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| InChIKey |
SYIRBUOZSOCAML-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