General Information of the Compound
| Compound ID |
CP0468067
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| Compound Name |
2-(1-adamantylmethyl)-1-cyano-3-pyridin-3-ylguanidine
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| Structure |
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| Formula |
C18H23N5
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| Molecular Weight |
309.417
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| Canonical SMILES |
N#C\N=C(/NCC12CC3CC(CC(C3)C1)C2)Nc1cccnc1
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| InChI |
InChI=1S/C18H23N5/c19-12-22-17(23-16-2-1-3-20-10-16)21-11-18-7-13-4-14(8-18)6-15(5-13)9-18/h1-3,10,13-15H,4-9,11H2,(H2,21,22,23)
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| InChIKey |
DGOSSMSJMBXUFK-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