General Information of the Compound
| Compound ID |
CP0439077
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| Compound Name |
1-cyano-3-[4-(1H-imidazol-5-yl)butyl]-2-(3-pyridin-2-ylpropyl)guanidine
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| Structure |
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| Formula |
C17H23N7
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| Molecular Weight |
325.42
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| Canonical SMILES |
N#CNC(NCCCc1ccccn1)=NCCCCc1cnc[nH]1
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| InChI |
InChI=1S/C17H23N7/c18-13-23-17(21-10-4-2-7-16-12-19-14-24-16)22-11-5-8-15-6-1-3-9-20-15/h1,3,6,9,12,14H,2,4-5,7-8,10-11H2,(H,19,24)(H2,21,22,23)
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| InChIKey |
PGKDLJHDJQXSHU-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