General Information of the Compound
| Compound ID |
CP0481398
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| Compound Name |
3-[3-(4-phenylpiperazin-1-yl)propyl-propylamino]phenol
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| Structure |
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| Formula |
C22H31N3O
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| Molecular Weight |
353.51
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| Canonical SMILES |
CCCN(CCCN1CCN(CC1)c1ccccc1)c1cccc(O)c1
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| InChI |
InChI=1S/C22H31N3O/c1-2-12-24(21-10-6-11-22(26)19-21)14-7-13-23-15-17-25(18-16-23)20-8-4-3-5-9-20/h3-6,8-11,19,26H,2,7,12-18H2,1H3
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| InChIKey |
LIUWRFHKSQCDOP-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