General Information of the Compound
| Compound ID |
CP0425343
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| Compound Name |
N-(cyclobutylmethyl)-3-[[4-(methylsulfinylmethyl)naphthalene-1-carbonyl]amino]pyrazine-2-carboxamide
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| Structure |
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| Formula |
C23H24N4O3S
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| Molecular Weight |
436.537
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| Canonical SMILES |
CS(=O)Cc1ccc(C(=O)Nc2nccnc2C(=O)NCC2CCC2)c2ccccc12
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| InChI |
InChI=1S/C23H24N4O3S/c1-31(30)14-16-9-10-19(18-8-3-2-7-17(16)18)22(28)27-21-20(24-11-12-25-21)23(29)26-13-15-5-4-6-15/h2-3,7-12,15H,4-6,13-14H2,1H3,(H,26,29)(H,25,27,28)
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| InChIKey |
RSYSXDBUOKOFIE-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: PT00834, Cannabinoid receptor 2
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2