General Information of the Compound
| Compound ID |
CP0155558
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| Compound Name |
3-[(4-methoxyphenyl)methoxy]-5-nitro-1-pentylindazole
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| Structure |
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| Formula |
C20H23N3O4
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| Molecular Weight |
369.421
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| Canonical SMILES |
CCCCCn1nc(OCc2ccc(OC)cc2)c2cc(ccc12)[N+]([O-])=O
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| InChI |
InChI=1S/C20H23N3O4/c1-3-4-5-12-22-19-11-8-16(23(24)25)13-18(19)20(21-22)27-14-15-6-9-17(26-2)10-7-15/h6-11,13H,3-5,12,14H2,1-2H3
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| InChIKey |
FZCLGOSOJHUUST-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