General Information of the Compound
| Compound ID |
CP0426999
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| Compound Name |
4-(Bis(2-chloroethyl)amino)-N-methyl-N-phenylbenzamide
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| Structure |
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| Formula |
C18H20Cl2N2O
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| Molecular Weight |
351.277
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| Canonical SMILES |
CN(C(=O)c1ccc(cc1)N(CCCl)CCCl)c1ccccc1
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| InChI |
InChI=1S/C18H20Cl2N2O/c1-21(16-5-3-2-4-6-16)18(23)15-7-9-17(10-8-15)22(13-11-19)14-12-20/h2-10H,11-14H2,1H3
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| InChIKey |
DYNSRIYCGYNKBV-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