General Information of the Compound
| Compound ID |
CP0279937
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| Compound Name |
2-fluoro-5-[5-(1H-indazol-5-ylcarbamoyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl]benzoic acid
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| Structure |
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| Formula |
C20H16FN5O4
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| Molecular Weight |
409.377
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| Canonical SMILES |
CC1=C(C(NC(=O)N1)c1ccc(F)c(c1)C(O)=O)C(=O)Nc1ccc2[nH]ncc2c1
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| InChI |
InChI=1S/C20H16FN5O4/c1-9-16(18(27)24-12-3-5-15-11(6-12)8-22-26-15)17(25-20(30)23-9)10-2-4-14(21)13(7-10)19(28)29/h2-8,17H,1H3,(H,22,26)(H,24,27)(H,28,29)(H2,23,25,30)
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| InChIKey |
SJWYJDDFSFWNTR-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