General Information of the Compound
| Compound ID |
CP0555190
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| Compound Name |
N-[[2-(2-fluorophenyl)phenyl]methyl]-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentanamide
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| Structure |
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| Formula |
C29H34FN3O2
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| Molecular Weight |
475.608
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCC(=O)NCc2ccccc2-c2ccccc2F)CC1
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| InChI |
InChI=1S/C29H34FN3O2/c1-35-28-15-7-6-14-27(28)33-20-18-32(19-21-33)17-9-8-16-29(34)31-22-23-10-2-3-11-24(23)25-12-4-5-13-26(25)30/h2-7,10-15H,8-9,16-22H2,1H3,(H,31,34)
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| InChIKey |
UEFGRCPYUMNDCK-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