General Information of the Compound
| Compound ID |
CP0502812
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| Compound Name |
2-Chloro-N-(3-chloro-benzyl)-benzamidine
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| Structure |
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| Formula |
C14H12Cl2N2
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| Molecular Weight |
279.17
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| Canonical SMILES |
NC(=NCc1cccc(Cl)c1)c1ccccc1Cl
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| InChI |
InChI=1S/C14H12Cl2N2/c15-11-5-3-4-10(8-11)9-18-14(17)12-6-1-2-7-13(12)16/h1-8H,9H2,(H2,17,18)
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| InChIKey |
ORVZSVIGLZUOBT-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