General Information of the Compound
| Compound ID |
CP0396187
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| Compound Name |
N-[5,6-bis(4-methylphenyl)pyridazin-3-yl]sulfanylcyclopentanamine
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| Structure |
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| Formula |
C23H25N3S
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| Molecular Weight |
375.541
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| Canonical SMILES |
Cc1ccc(cc1)-c1cc(SNC2CCCC2)nnc1-c1ccc(C)cc1
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| InChI |
InChI=1S/C23H25N3S/c1-16-7-11-18(12-8-16)21-15-22(27-26-20-5-3-4-6-20)24-25-23(21)19-13-9-17(2)10-14-19/h7-15,20,26H,3-6H2,1-2H3
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| InChIKey |
SXNOITRYWQUKRY-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: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2