General Information of the Compound
| Compound ID |
CP0418700
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| Compound Name |
2-[(4-chlorophenyl)methyl-[1-[2-(3,5-dimethylphenyl)acetyl]-2-methylazetidine-2-carbonyl]amino]acetic acid
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| Structure |
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| Formula |
C24H27ClN2O4
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| Molecular Weight |
442.943
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| Canonical SMILES |
Cc1cc(C)cc(CC(=O)N2CCC2(C)C(=O)N(CC(O)=O)Cc2ccc(Cl)cc2)c1
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| InChI |
InChI=1S/C24H27ClN2O4/c1-16-10-17(2)12-19(11-16)13-21(28)27-9-8-24(27,3)23(31)26(15-22(29)30)14-18-4-6-20(25)7-5-18/h4-7,10-12H,8-9,13-15H2,1-3H3,(H,29,30)
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| InChIKey |
QZLNDKVANIBWLI-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