General Information of the Compound
| Compound ID |
CP0282476
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| Compound Name |
1-[3-(Methylsulfonyl)phenyl]-4-propylpiperazine
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| Synonyms |
1-[3-(Methylsulfonyl)phenyl]-4-propylpiperazine
BDBM50308027
CHEMBL596801
IIFAQXPNYXJBMU-UHFFFAOYSA-N
SCHEMBL3453749
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| Structure |
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| Formula |
C14H22N2O2S
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| Molecular Weight |
282.409
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| Canonical SMILES |
CCCN1CCN(CC1)c1cccc(c1)S(C)(=O)=O
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| InChI |
InChI=1S/C14H22N2O2S/c1-3-7-15-8-10-16(11-9-15)13-5-4-6-14(12-13)19(2,17)18/h4-6,12H,3,7-11H2,1-2H3
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| InChIKey |
IIFAQXPNYXJBMU-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
Clinical Information about the Compound