General Information of the Compound
| Compound ID |
CP0199413
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| Compound Name |
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-2-[3-(trifluoromethyl)anilino]benzamide
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| Structure |
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| Formula |
C24H20F3N3O2
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| Molecular Weight |
439.437
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| Canonical SMILES |
Oc1ccc2[nH]cc(CCNC(=O)c3ccccc3Nc3cccc(c3)C(F)(F)F)c2c1
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| InChI |
InChI=1S/C24H20F3N3O2/c25-24(26,27)16-4-3-5-17(12-16)30-22-7-2-1-6-19(22)23(32)28-11-10-15-14-29-21-9-8-18(31)13-20(15)21/h1-9,12-14,29-31H,10-11H2,(H,28,32)
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| InChIKey |
OVXPBTKDVIMQPO-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