General Information of the Compound
| Compound ID |
CP0476909
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| Compound Name |
4-[[3-methoxy-4-[(4-pyrrol-1-ylphenyl)methoxy]phenyl]methylamino]benzenecarboximidamide
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| Structure |
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| Formula |
C26H26N4O2
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| Molecular Weight |
426.52
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| Canonical SMILES |
COc1cc(CNc2ccc(cc2)C(N)=N)ccc1OCc1ccc(cc1)-n1cccc1
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| InChI |
InChI=1S/C26H26N4O2/c1-31-25-16-20(17-29-22-9-7-21(8-10-22)26(27)28)6-13-24(25)32-18-19-4-11-23(12-5-19)30-14-2-3-15-30/h2-16,29H,17-18H2,1H3,(H3,27,28)
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| InChIKey |
LKPDGOFVJWTLMQ-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