General Information of the Compound
| Compound ID |
CP0445309
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| Compound Name |
N-[2-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichloro-N-methylanilino]-2-oxoethyl]-4-phenylbutanamide
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| Structure |
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| Formula |
C28H27BrCl2N4O3
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| Molecular Weight |
618.359
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| Canonical SMILES |
CN(C(=O)CNC(=O)CCCc1ccccc1)c1ccc(Cl)c(COc2cccn3c(Br)c(C)nc23)c1Cl
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| InChI |
InChI=1S/C28H27BrCl2N4O3/c1-18-27(29)35-15-7-11-23(28(35)33-18)38-17-20-21(30)13-14-22(26(20)31)34(2)25(37)16-32-24(36)12-6-10-19-8-4-3-5-9-19/h3-5,7-9,11,13-15H,6,10,12,16-17H2,1-2H3,(H,32,36)
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| InChIKey |
TYQARXWSHFLONS-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