General Information of the Compound
| Compound ID |
CP0430655
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| Compound Name |
N-(naphthalen-2-ylmethyl)-N-piperidin-4-ylmethanesulfonamide
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| Structure |
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| Formula |
C17H22N2O2S
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| Molecular Weight |
318.442
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| Canonical SMILES |
CS(=O)(=O)N(Cc1ccc2ccccc2c1)C1CCNCC1
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| InChI |
InChI=1S/C17H22N2O2S/c1-22(20,21)19(17-8-10-18-11-9-17)13-14-6-7-15-4-2-3-5-16(15)12-14/h2-7,12,17-18H,8-11,13H2,1H3
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| InChIKey |
HZPZVEJWTPAYPU-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter