General Information of the Compound
| Compound ID |
CP0453229
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| Compound Name |
1-benzyl-4-(4-phenylpiperazin-1-yl)piperidin-3-ol
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| Structure |
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| Formula |
C22H29N3O
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| Molecular Weight |
351.494
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| Canonical SMILES |
OC1CN(Cc2ccccc2)CCC1N1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C22H29N3O/c26-22-18-23(17-19-7-3-1-4-8-19)12-11-21(22)25-15-13-24(14-16-25)20-9-5-2-6-10-20/h1-10,21-22,26H,11-18H2
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| InChIKey |
YQRZGAQHXYANNE-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