General Information of the Compound
| Compound ID |
CP0454546
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| Compound Name |
2-methyl-1-[3-phenylmethoxy-4-(3-phenylpropoxy)phenyl]guanidine
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| Structure |
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| Formula |
C24H27N3O2
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| Molecular Weight |
389.499
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| Canonical SMILES |
CNC(N)=Nc1ccc(OCCCc2ccccc2)c(OCc2ccccc2)c1
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| InChI |
InChI=1S/C24H27N3O2/c1-26-24(25)27-21-14-15-22(28-16-8-13-19-9-4-2-5-10-19)23(17-21)29-18-20-11-6-3-7-12-20/h2-7,9-12,14-15,17H,8,13,16,18H2,1H3,(H3,25,26,27)
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| InChIKey |
MOJZYEHPYHJGCX-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