General Information of the Compound
| Compound ID |
CP0430371
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| Compound Name |
1-cyano-3-[4-(1H-imidazol-5-yl)butyl]-2-(3-phenylpropyl)guanidine
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| Structure |
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| Formula |
C18H24N6
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| Molecular Weight |
324.432
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| Canonical SMILES |
N#CNC(NCCCc1ccccc1)=NCCCCc1cnc[nH]1
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| InChI |
InChI=1S/C18H24N6/c19-14-23-18(21-11-5-4-10-17-13-20-15-24-17)22-12-6-9-16-7-2-1-3-8-16/h1-3,7-8,13,15H,4-6,9-12H2,(H,20,24)(H2,21,22,23)
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| InChIKey |
LCJIVFNCQGPKLP-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