General Information of the Compound
| Compound ID |
CP0548549
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| Compound Name |
4-fluoro-N-[(1S,2S)-2-methyl-1-[5-(2-methylpyrimidin-4-yl)-7,8-dihydro-6H-1,5-naphthyridin-2-yl]cyclopropyl]benzamide
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| Structure |
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| Formula |
C24H24FN5O
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| Molecular Weight |
417.488
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| Canonical SMILES |
C[C@H]1C[C@@]1(NC(=O)c1ccc(F)cc1)c1ccc2N(CCCc2n1)c1ccnc(C)n1
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| InChI |
InChI=1S/C24H24FN5O/c1-15-14-24(15,29-23(31)17-5-7-18(25)8-6-17)21-10-9-20-19(28-21)4-3-13-30(20)22-11-12-26-16(2)27-22/h5-12,15H,3-4,13-14H2,1-2H3,(H,29,31)/t15-,24-/m0/s1
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| InChIKey |
FOBMFHHWWZOPLN-OWJWWREXSA-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