General Information of the Compound
| Compound ID |
CP0419079
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| Compound Name |
4-Methoxy-N-{3-[4-(p-methoxyphenyl)-piperazin-1-yl]-propyl}-benzenesulfonamide
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| Structure |
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| Formula |
C21H29N3O4S
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| Molecular Weight |
419.547
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| Canonical SMILES |
COc1ccc(cc1)N1CCN(CCCNS(=O)(=O)c2ccc(OC)cc2)CC1
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| InChI |
InChI=1S/C21H29N3O4S/c1-27-19-6-4-18(5-7-19)24-16-14-23(15-17-24)13-3-12-22-29(25,26)21-10-8-20(28-2)9-11-21/h4-11,22H,3,12-17H2,1-2H3
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| InChIKey |
VRFGAKFDWUFAQO-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