General Information of the Compound
| Compound ID |
CP0384273
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| Compound Name |
N-[[3-(3-chlorophenyl)-4-methoxyphenyl]methyl]-4-fluoroaniline
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| Structure |
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| Formula |
C20H17ClFNO
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| Molecular Weight |
341.813
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| Canonical SMILES |
COc1ccc(CNc2ccc(F)cc2)cc1-c1cccc(Cl)c1
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| InChI |
InChI=1S/C20H17ClFNO/c1-24-20-10-5-14(13-23-18-8-6-17(22)7-9-18)11-19(20)15-3-2-4-16(21)12-15/h2-12,23H,13H2,1H3
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| InChIKey |
GUPNOXNZMQNDNR-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