General Information of the Compound
| Compound ID |
CP0416941
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| Compound Name |
2-(4-fluorophenyl)-N-[3-(4-methylimidazol-1-yl)propyl]aniline
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| Structure |
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| Formula |
C19H20FN3
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| Molecular Weight |
309.388
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| Canonical SMILES |
Cc1cn(CCCNc2ccccc2-c2ccc(F)cc2)cn1
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| InChI |
InChI=1S/C19H20FN3/c1-15-13-23(14-22-15)12-4-11-21-19-6-3-2-5-18(19)16-7-9-17(20)10-8-16/h2-3,5-10,13-14,21H,4,11-12H2,1H3
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| InChIKey |
GKLQJZRXGKCXRX-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