General Information of the Compound
| Compound ID |
CP0553987
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| Compound Name |
1-(3-cyclopropyl-2-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C16H16FNO2
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| Molecular Weight |
273.307
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| Canonical SMILES |
Cc1cc(C(O)=O)c(C)n1-c1cccc(C2CC2)c1F
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| InChI |
InChI=1S/C16H16FNO2/c1-9-8-13(16(19)20)10(2)18(9)14-5-3-4-12(15(14)17)11-6-7-11/h3-5,8,11H,6-7H2,1-2H3,(H,19,20)
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| InChIKey |
YOMSYLISCZDKGI-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