General Information of the Compound
| Compound ID |
CP0175226
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| Compound Name |
4-chloro-3-[1-(2-chloro-6-fluorobenzoyl)-3,3-dimethyl-2,4-dihydroquinolin-6-yl]benzamide
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| Structure |
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| Formula |
C25H21Cl2FN2O2
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| Molecular Weight |
471.359
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| Canonical SMILES |
CC1(C)CN(C(=O)c2c(F)cccc2Cl)c2ccc(cc2C1)-c1cc(ccc1Cl)C(N)=O
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| InChI |
InChI=1S/C25H21Cl2FN2O2/c1-25(2)12-16-10-14(17-11-15(23(29)31)6-8-18(17)26)7-9-21(16)30(13-25)24(32)22-19(27)4-3-5-20(22)28/h3-11H,12-13H2,1-2H3,(H2,29,31)
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| InChIKey |
ZSMGSVGOQSVDME-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