General Information of the Compound
| Compound ID |
CP0501098
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| Compound Name |
N-[5-[2-(benzylamino)ethoxy]-2-chlorophenyl]methanesulfonamide
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| Structure |
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| Formula |
C16H19ClN2O3S
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| Molecular Weight |
354.859
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| Canonical SMILES |
CS(=O)(=O)Nc1cc(OCCNCc2ccccc2)ccc1Cl
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| InChI |
InChI=1S/C16H19ClN2O3S/c1-23(20,21)19-16-11-14(7-8-15(16)17)22-10-9-18-12-13-5-3-2-4-6-13/h2-8,11,18-19H,9-10,12H2,1H3
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| InChIKey |
GJAYJBGLRYDTKW-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor