General Information of the Compound
| Compound ID |
CP0438138
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| Compound Name |
2-methyl-1-(4-phenylmethoxy-3-thiophen-2-ylphenyl)guanidine
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| Structure |
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| Formula |
C19H19N3OS
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| Molecular Weight |
337.448
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| Canonical SMILES |
CNC(N)=Nc1ccc(OCc2ccccc2)c(c1)-c1cccs1
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| InChI |
InChI=1S/C19H19N3OS/c1-21-19(20)22-15-9-10-17(16(12-15)18-8-5-11-24-18)23-13-14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H3,20,21,22)
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| InChIKey |
XLCREAKGDZJEDW-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