General Information of the Compound
| Compound ID |
CP0423352
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| Compound Name |
4-fluoro-N-[1-[5-[2-(trifluoromethyl)pyrimidin-4-yl]-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclopropyl]benzamide
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| Structure |
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| Formula |
C23H19F4N5O
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| Molecular Weight |
457.431
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)NC1(CC1)c1ccc2N(CCCc2n1)c1ccnc(n1)C(F)(F)F
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| InChI |
InChI=1S/C23H19F4N5O/c24-15-5-3-14(4-6-15)20(33)31-22(10-11-22)18-8-7-17-16(29-18)2-1-13-32(17)19-9-12-28-21(30-19)23(25,26)27/h3-9,12H,1-2,10-11,13H2,(H,31,33)
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| InChIKey |
LJWSQXCSHAHBJB-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