General Information of the Compound
| Compound ID |
CP0380637
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| Compound Name |
N-[2-[4-(diethylamino)phenyl]ethyl]-5-fluoro-3-methyl-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C22H26FN3O
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| Molecular Weight |
367.468
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| Canonical SMILES |
CCN(CC)c1ccc(CCNC(=O)c2[nH]c3ccc(F)cc3c2C)cc1
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| InChI |
InChI=1S/C22H26FN3O/c1-4-26(5-2)18-9-6-16(7-10-18)12-13-24-22(27)21-15(3)19-14-17(23)8-11-20(19)25-21/h6-11,14,25H,4-5,12-13H2,1-3H3,(H,24,27)
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| InChIKey |
UUUUKDIKVIQJQX-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