General Information of the Compound
| Compound ID |
CP0456017
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| Compound Name |
1-(1-adamantyl)-N-(2-morpholin-4-ylethyl)triazol-4-amine
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| Structure |
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| Formula |
C18H29N5O
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| Molecular Weight |
331.464
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| Canonical SMILES |
C(CN1CCOCC1)Nc1cn(nn1)C12CC3CC(CC(C3)C1)C2
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| InChI |
InChI=1S/C18H29N5O/c1(2-22-3-5-24-6-4-22)19-17-13-23(21-20-17)18-10-14-7-15(11-18)9-16(8-14)12-18/h13-16,19H,1-12H2
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| InChIKey |
YEYVFPUAOZMEEH-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: PT01509, Sigma non-opioid intracellular receptor 1