General Information of the Compound
| Compound ID |
CP0479473
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| Compound Name |
3,4-dichloro-N-[3-[[4-[3-(dimethylamino)propoxy]phenyl]methyl-methylamino]propyl]benzamide
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| Structure |
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| Formula |
C23H31Cl2N3O2
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| Molecular Weight |
452.426
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| Canonical SMILES |
CN(C)CCCOc1ccc(CN(C)CCCNC(=O)c2ccc(Cl)c(Cl)c2)cc1
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| InChI |
InChI=1S/C23H31Cl2N3O2/c1-27(2)13-5-15-30-20-9-6-18(7-10-20)17-28(3)14-4-12-26-23(29)19-8-11-21(24)22(25)16-19/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,26,29)
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| InChIKey |
BVHMEFMIZAWJTC-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