General Information of the Compound
| Compound ID |
CP0486976
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| Compound Name |
4-fluoro-N-[2-(1H-indol-3-ylmethylamino)ethyl]benzamide
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| Structure |
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| Formula |
C18H18FN3O
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| Molecular Weight |
311.36
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)NCCNCc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C18H18FN3O/c19-15-7-5-13(6-8-15)18(23)21-10-9-20-11-14-12-22-17-4-2-1-3-16(14)17/h1-8,12,20,22H,9-11H2,(H,21,23)
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| InChIKey |
ISXRMTZDLBSXGP-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