General Information of the Compound
| Compound ID |
CP0378602
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| Compound Name |
2-[5-(3-chloro-4-fluorophenyl)-1-(cyclopropylmethyl)indol-3-yl]acetamide
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| Structure |
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| Formula |
C20H18ClFN2O
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| Molecular Weight |
356.828
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| Canonical SMILES |
NC(=O)Cc1cn(CC2CC2)c2ccc(cc12)-c1ccc(F)c(Cl)c1
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| InChI |
InChI=1S/C20H18ClFN2O/c21-17-8-14(3-5-18(17)22)13-4-6-19-16(7-13)15(9-20(23)25)11-24(19)10-12-1-2-12/h3-8,11-12H,1-2,9-10H2,(H2,23,25)
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| InChIKey |
KRLMIQHKGVWSQC-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