General Information of the Compound
| Compound ID |
CP0580065
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| Compound Name |
5-cyclopropyl-1-[3-[3-[cyclopropylmethyl(methyl)carbamoyl]-2-fluorophenyl]phenyl]pyrazole-4-carboxylic acid
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| Structure |
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| Formula |
C25H24FN3O3
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| Molecular Weight |
433.483
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| Canonical SMILES |
CN(CC1CC1)C(=O)c1cccc(c1F)-c1cccc(c1)-n1ncc(C(O)=O)c1C1CC1
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| InChI |
InChI=1S/C25H24FN3O3/c1-28(14-15-8-9-15)24(30)20-7-3-6-19(22(20)26)17-4-2-5-18(12-17)29-23(16-10-11-16)21(13-27-29)25(31)32/h2-7,12-13,15-16H,8-11,14H2,1H3,(H,31,32)
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| InChIKey |
DVUZTCBOJDHAAL-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