General Information of the Compound
| Compound ID |
CP0543040
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| Compound Name |
2-[(3-chlorophenyl)methoxy]-4-[(5-phenyl-1H-imidazol-2-yl)methylamino]benzenecarboximidamide
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| Structure |
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| Formula |
C24H22ClN5O
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| Molecular Weight |
431.927
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| Canonical SMILES |
NC(=N)c1ccc(NCc2nc(c[nH]2)-c2ccccc2)cc1OCc1cccc(Cl)c1
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| InChI |
InChI=1S/C24H22ClN5O/c25-18-8-4-5-16(11-18)15-31-22-12-19(9-10-20(22)24(26)27)28-14-23-29-13-21(30-23)17-6-2-1-3-7-17/h1-13,28H,14-15H2,(H3,26,27)(H,29,30)
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| InChIKey |
ABRSGLJVNXRJGH-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
Protein ID: PT01859, Kallikrein-1
Protein ID: PT02568, Kallikrein-5