General Information of the Compound
| Compound ID |
CP0410512
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| Compound Name |
3-[3-({[3-(3-Bromo-2-methyl-imidazo[1,2-a]pyridin-8-yloxymethyl)-2,4-dichloro-phenyl]-methyl-carbamoyl}-methyl)-ureido]-benzoic acid
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| Structure |
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| Formula |
C26H22BrCl2N5O5
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| Molecular Weight |
635.302
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| Canonical SMILES |
CN(C(=O)CNC(=O)Nc1cccc(c1)C(O)=O)c1ccc(Cl)c(COc2cccn3c(Br)c(C)nc23)c1Cl
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| InChI |
InChI=1S/C26H22BrCl2N5O5/c1-14-23(27)34-10-4-7-20(24(34)31-14)39-13-17-18(28)8-9-19(22(17)29)33(2)21(35)12-30-26(38)32-16-6-3-5-15(11-16)25(36)37/h3-11H,12-13H2,1-2H3,(H,36,37)(H2,30,32,38)
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| InChIKey |
IQUVJGNYIACOPA-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