General Information of the Compound
| Compound ID |
CP0277857
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| Compound Name |
2-[4-(4-Benzyl-phenyl)-piperazin-1-yl]-N-m-tolyl-acetamide
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| Structure |
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| Formula |
C26H29N3O
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| Molecular Weight |
399.538
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| Canonical SMILES |
Cc1cccc(NC(=O)CN2CCN(CC2)c2ccc(Cc3ccccc3)cc2)c1
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| InChI |
InChI=1S/C26H29N3O/c1-21-6-5-9-24(18-21)27-26(30)20-28-14-16-29(17-15-28)25-12-10-23(11-13-25)19-22-7-3-2-4-8-22/h2-13,18H,14-17,19-20H2,1H3,(H,27,30)
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| InChIKey |
CHJYPPWGALSSOA-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