General Information of the Compound
| Compound ID |
CP0456354
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| Compound Name |
N-[[3-(4-fluoro-2-methoxyphenyl)phenyl]methyl]cyclopentanamine
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| Structure |
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| Formula |
C19H22FNO
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| Molecular Weight |
299.389
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| Canonical SMILES |
COc1cc(F)ccc1-c1cccc(CNC2CCCC2)c1
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| InChI |
InChI=1S/C19H22FNO/c1-22-19-12-16(20)9-10-18(19)15-6-4-5-14(11-15)13-21-17-7-2-3-8-17/h4-6,9-12,17,21H,2-3,7-8,13H2,1H3
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| InChIKey |
KSYYFCDUINESKT-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