General Information of the Compound
| Compound ID |
CP0257000
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| Compound Name |
3-methoxy-6-[(1R)-1-[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl]-1,6-naphthyridin-5-one
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| Structure |
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| Formula |
C21H19N7O2
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| Molecular Weight |
401.43
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| Canonical SMILES |
COc1cnc2ccn([C@H](C)c3nnc4ccc(cn34)-c3cnn(C)c3)c(=O)c2c1
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| InChI |
InChI=1S/C21H19N7O2/c1-13(27-7-6-18-17(21(27)29)8-16(30-3)10-22-18)20-25-24-19-5-4-14(12-28(19)20)15-9-23-26(2)11-15/h4-13H,1-3H3/t13-/m1/s1
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| InChIKey |
OBCCECQELHQOEU-CYBMUJFWSA-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