General Information of the Compound
| Compound ID |
CP0412119
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| Compound Name |
5-fluoro-3-[3-[4-(4-fluoro-2-phenylphenyl)piperidin-1-yl]propyl]-1H-indole
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| Structure |
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| Formula |
C28H28F2N2
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| Molecular Weight |
430.542
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| Canonical SMILES |
Fc1ccc(C2CCN(CCCc3c[nH]c4ccc(F)cc34)CC2)c(c1)-c1ccccc1
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| InChI |
InChI=1S/C28H28F2N2/c29-23-8-10-25(26(17-23)20-5-2-1-3-6-20)21-12-15-32(16-13-21)14-4-7-22-19-31-28-11-9-24(30)18-27(22)28/h1-3,5-6,8-11,17-19,21,31H,4,7,12-16H2
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| InChIKey |
DFEVQPHSPAIFED-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