General Information of the Compound
| Compound ID |
CP0508990
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| Compound Name |
3-[3,4-dichloro-N-[(4-fluorophenyl)methyl]anilino]-1-morpholin-4-ylpropan-1-one
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| Structure |
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| Formula |
C20H21Cl2FN2O2
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| Molecular Weight |
411.304
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| Canonical SMILES |
Fc1ccc(CN(CCC(=O)N2CCOCC2)c2ccc(Cl)c(Cl)c2)cc1
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| InChI |
InChI=1S/C20H21Cl2FN2O2/c21-18-6-5-17(13-19(18)22)25(14-15-1-3-16(23)4-2-15)8-7-20(26)24-9-11-27-12-10-24/h1-6,13H,7-12,14H2
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| InChIKey |
PVRHCAWIVUXXDL-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