General Information of the Compound
| Compound ID |
CP0373981
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| Compound Name |
1-(5-tert-butyl-2-pyridin-3-ylpyrazol-3-yl)-3-[4-[(1-methyl-2-oxo-3H-imidazo[4,5-b]pyridin-7-yl)oxy]naphthalen-1-yl]urea
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| Structure |
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| Formula |
C30H28N8O3
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| Molecular Weight |
548.607
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| Canonical SMILES |
Cn1c2c(Oc3ccc(NC(=O)Nc4cc(nn4-c4cccnc4)C(C)(C)C)c4ccccc34)ccnc2[nH]c1=O
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| InChI |
InChI=1S/C30H28N8O3/c1-30(2,3)24-16-25(38(36-24)18-8-7-14-31-17-18)34-28(39)33-21-11-12-22(20-10-6-5-9-19(20)21)41-23-13-15-32-27-26(23)37(4)29(40)35-27/h5-17H,1-4H3,(H,32,35,40)(H2,33,34,39)
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| InChIKey |
JBNYIHPVUCADJR-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