General Information of the Compound
| Compound ID |
CP0203172
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| Compound Name |
4-(4-chloro-3-fluorophenyl)-2-methyl-7-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetrahydro-2,6-naphthyridine
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| Structure |
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| Formula |
C23H29ClFN3O
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| Molecular Weight |
417.956
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| Canonical SMILES |
CN1CC(c2ccc(Cl)c(F)c2)c2cnc(OCCCN3CCCCC3)cc2C1
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| InChI |
InChI=1S/C23H29ClFN3O/c1-27-15-18-13-23(29-11-5-10-28-8-3-2-4-9-28)26-14-19(18)20(16-27)17-6-7-21(24)22(25)12-17/h6-7,12-14,20H,2-5,8-11,15-16H2,1H3
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| InChIKey |
PJDNBOOJSSZQPJ-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