General Information of the Compound
| Compound ID |
CP0431676
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| Compound Name |
3-[1-(2-chloro-5-fluorophenyl)ethoxy]-5-(4-piperidin-4-ylphenyl)pyridin-2-amine
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| Structure |
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| Formula |
C24H25ClFN3O
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| Molecular Weight |
425.935
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| Canonical SMILES |
CC(Oc1cc(cnc1N)-c1ccc(cc1)C1CCNCC1)c1cc(F)ccc1Cl
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| InChI |
InChI=1S/C24H25ClFN3O/c1-15(21-13-20(26)6-7-22(21)25)30-23-12-19(14-29-24(23)27)17-4-2-16(3-5-17)18-8-10-28-11-9-18/h2-7,12-15,18,28H,8-11H2,1H3,(H2,27,29)
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| InChIKey |
BGDAPWLDXCPALX-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