General Information of the Compound
| Compound ID |
CP0915487
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| Compound Name |
N-{[4-(3-Chlorophenyl)piperazin-1-yl]-(imino)methyl}guanidine dihydrochloride
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| Structure |
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| Formula |
C12H19Cl3N6
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| Molecular Weight |
353.685
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| Canonical SMILES |
Cl.Cl.N=C(N)/N=C(\N)N1CCN(c2cccc(Cl)c2)CC1
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| InChI |
InChI=1S/C12H17ClN6.2ClH/c13-9-2-1-3-10(8-9)18-4-6-19(7-5-18)12(16)17-11(14)15;;/h1-3,8H,4-7H2,(H5,14,15,16,17);2*1H
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| InChIKey |
FLRJAUMFLGVKBZ-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