General Information of the Compound
| Compound ID |
CP0410776
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| Compound Name |
N-[2-[acetyl-[(2-methoxyphenyl)methyl]amino]-1-(3,4-dichlorophenyl)ethyl]-2-(4-phenylpiperazin-1-yl)acetamide
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| Structure |
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| Formula |
C30H34Cl2N4O3
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| Molecular Weight |
569.533
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| Canonical SMILES |
COc1ccccc1CN(CC(NC(=O)CN1CCN(CC1)c1ccccc1)c1ccc(Cl)c(Cl)c1)C(C)=O
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| InChI |
InChI=1S/C30H34Cl2N4O3/c1-22(37)36(19-24-8-6-7-11-29(24)39-2)20-28(23-12-13-26(31)27(32)18-23)33-30(38)21-34-14-16-35(17-15-34)25-9-4-3-5-10-25/h3-13,18,28H,14-17,19-21H2,1-2H3,(H,33,38)
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| InChIKey |
PDJRNVXFLCXTET-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