General Information of the Compound
| Compound ID |
CP0244900
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| Compound Name |
(8R)-N-(4-fluorophenyl)-8-[4-(trifluoromethyl)phenyl]-6,8-dihydro-5H-1,7-naphthyridine-7-carboxamide
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| Structure |
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| Formula |
C22H17F4N3O
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| Molecular Weight |
415.39
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| Canonical SMILES |
Fc1ccc(NC(=O)N2CCc3cccnc3[C@H]2c2ccc(cc2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C22H17F4N3O/c23-17-7-9-18(10-8-17)28-21(30)29-13-11-14-2-1-12-27-19(14)20(29)15-3-5-16(6-4-15)22(24,25)26/h1-10,12,20H,11,13H2,(H,28,30)/t20-/m1/s1
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| InChIKey |
PDHSWFCNOPFHAS-HXUWFJFHSA-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