General Information of the Compound
| Compound ID |
CP0566528
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| Compound Name |
3-[3-(4-phenylpiperazin-1-yl)propyl]phenol;hydrochloride
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| Structure |
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| Formula |
C19H25ClN2O
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| Molecular Weight |
332.875
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| Canonical SMILES |
Cl.Oc1cccc(CCCN2CCN(CC2)c2ccccc2)c1
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| InChI |
InChI=1S/C19H24N2O.ClH/c22-19-10-4-6-17(16-19)7-5-11-20-12-14-21(15-13-20)18-8-2-1-3-9-18;/h1-4,6,8-10,16,22H,5,7,11-15H2;1H
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| InChIKey |
PPOJMFWCWXKQAI-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