General Information of the Compound
| Compound ID |
CP0504981
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| Compound Name |
2-[5-[3,5-bis(trifluoromethyl)phenyl]-1-(cyclopropylmethyl)indol-3-yl]acetamide
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| Structure |
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| Formula |
C22H18F6N2O
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| Molecular Weight |
440.387
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| Canonical SMILES |
NC(=O)Cc1cn(CC2CC2)c2ccc(cc12)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C22H18F6N2O/c23-21(24,25)16-5-14(6-17(9-16)22(26,27)28)13-3-4-19-18(7-13)15(8-20(29)31)11-30(19)10-12-1-2-12/h3-7,9,11-12H,1-2,8,10H2,(H2,29,31)
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| InChIKey |
GCQDJOGNVLDTPN-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