General Information of the Compound
| Compound ID |
CP0566523
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| Compound Name |
N,3-dimethyl-N-[3-(4-phenylpiperazin-1-yl)propyl]aniline
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| Structure |
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| Formula |
C21H29N3
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| Molecular Weight |
323.484
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| Canonical SMILES |
CN(CCCN1CCN(CC1)c1ccccc1)c1cccc(C)c1
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| InChI |
InChI=1S/C21H29N3/c1-19-8-6-11-21(18-19)22(2)12-7-13-23-14-16-24(17-15-23)20-9-4-3-5-10-20/h3-6,8-11,18H,7,12-17H2,1-2H3
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| InChIKey |
TVXVCBFNYMQZAH-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