General Information of the Compound
| Compound ID |
CP0517599
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| Compound Name |
4-(Bis(2-chloroethyl)amino)-N-dodecylbenzamide
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| Structure |
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| Formula |
C23H38Cl2N2O
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| Molecular Weight |
429.476
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| Canonical SMILES |
CCCCCCCCCCCCNC(=O)c1ccc(cc1)N(CCCl)CCCl
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| InChI |
InChI=1S/C23H38Cl2N2O/c1-2-3-4-5-6-7-8-9-10-11-18-26-23(28)21-12-14-22(15-13-21)27(19-16-24)20-17-25/h12-15H,2-11,16-20H2,1H3,(H,26,28)
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| InChIKey |
NVXIKQZUYLCXPF-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