General Information of the Compound
| Compound ID |
CP0480610
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| Compound Name |
N-[(4-chlorophenyl)methyl]-N,2-dimethyl-1-[2-(4-phenylphenyl)acetyl]azetidine-2-carboxamide
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| Structure |
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| Formula |
C27H27ClN2O2
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| Molecular Weight |
446.978
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| Canonical SMILES |
CN(Cc1ccc(Cl)cc1)C(=O)C1(C)CCN1C(=O)Cc1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C27H27ClN2O2/c1-27(26(32)29(2)19-21-10-14-24(28)15-11-21)16-17-30(27)25(31)18-20-8-12-23(13-9-20)22-6-4-3-5-7-22/h3-15H,16-19H2,1-2H3
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| InChIKey |
DXADTEIDFFSVKJ-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