General Information of the Compound
| Compound ID |
CP0486612
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| Compound Name |
4-(4-Chloro-phenyl)-1-(4-phenyl-4-m-tolyl-butyl)-piperidin-4-ol
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| Structure |
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| Formula |
C28H32ClNO
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| Molecular Weight |
434.023
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| Canonical SMILES |
Cc1cccc(c1)C(CCCN1CCC(O)(CC1)c1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C28H32ClNO/c1-22-7-5-10-24(21-22)27(23-8-3-2-4-9-23)11-6-18-30-19-16-28(31,17-20-30)25-12-14-26(29)15-13-25/h2-5,7-10,12-15,21,27,31H,6,11,16-20H2,1H3
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| InChIKey |
XFNLYSXDMPXNNA-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