General Information of the Compound
| Compound ID |
CP0394079
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| Compound Name |
N-(1-adamantyl)-2-cyclopentyl-3-oxo-6-phenylpyridazine-4-carboxamide
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| Structure |
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| Formula |
C26H31N3O2
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| Molecular Weight |
417.553
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| Canonical SMILES |
O=C(NC12CC3CC(CC(C3)C1)C2)c1cc(nn(C2CCCC2)c1=O)-c1ccccc1
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| InChI |
InChI=1S/C26H31N3O2/c30-24(27-26-14-17-10-18(15-26)12-19(11-17)16-26)22-13-23(20-6-2-1-3-7-20)28-29(25(22)31)21-8-4-5-9-21/h1-3,6-7,13,17-19,21H,4-5,8-12,14-16H2,(H,27,30)
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| InChIKey |
RINTXKGYGCUYIV-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