General Information of the Compound
| Compound ID |
CP0430835
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| Compound Name |
N-(cyclohexylmethyl)-N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]naphthalene-2-sulfonamide
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| Structure |
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| Formula |
C31H41N3O3S
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| Molecular Weight |
535.754
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCN(CC2CCCCC2)S(=O)(=O)c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C31H41N3O3S/c1-37-31-15-8-7-14-30(31)33-22-20-32(21-23-33)18-9-19-34(25-26-10-3-2-4-11-26)38(35,36)29-17-16-27-12-5-6-13-28(27)24-29/h5-8,12-17,24,26H,2-4,9-11,18-23,25H2,1H3
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| InChIKey |
DVKVDTQSWBEYCJ-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C
Protein ID: PT00941, 5-hydroxytryptamine receptor 7