General Information of the Compound
| Compound ID |
CP0563631
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| Compound Name |
4-(4-chlorophenyl)-N-[2-[4-[[[2-(dimethylamino)-2-oxoethyl]-ethylamino]methyl]phenyl]ethyl]benzamide
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| Structure |
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| Formula |
C28H32ClN3O2
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| Molecular Weight |
478.036
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| Canonical SMILES |
CCN(CC(=O)N(C)C)Cc1ccc(CCNC(=O)c2ccc(cc2)-c2ccc(Cl)cc2)cc1
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| InChI |
InChI=1S/C28H32ClN3O2/c1-4-32(20-27(33)31(2)3)19-22-7-5-21(6-8-22)17-18-30-28(34)25-11-9-23(10-12-25)24-13-15-26(29)16-14-24/h5-16H,4,17-20H2,1-3H3,(H,30,34)
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| InChIKey |
SWIHLLWYHYBVDJ-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