General Information of the Compound
| Compound ID |
CP0871650
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| Compound Name |
N-{3-[2-(4-Carbamimidamidophenyl)ethyl]phenyl}acetamide hydrochloride
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| Structure |
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| Formula |
C17H21ClN4O
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| Molecular Weight |
332.835
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| Canonical SMILES |
CC(=O)Nc1cccc(CCc2ccc(NC(=N)N)cc2)c1.Cl
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| InChI |
InChI=1S/C17H20N4O.ClH/c1-12(22)20-16-4-2-3-14(11-16)6-5-13-7-9-15(10-8-13)21-17(18)19;/h2-4,7-11H,5-6H2,1H3,(H,20,22)(H4,18,19,21);1H
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| InChIKey |
RKZVBWPRAWJEQT-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