General Information of the Compound
| Compound ID |
CP0421689
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| Compound Name |
2-[4-[(4-fluoro-2-propylbenzimidazol-1-yl)methyl]phenyl]benzoic acid
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| Structure |
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| Formula |
C24H21FN2O2
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| Molecular Weight |
388.442
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| Canonical SMILES |
CCCc1nc2c(F)cccc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O
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| InChI |
InChI=1S/C24H21FN2O2/c1-2-6-22-26-23-20(25)9-5-10-21(23)27(22)15-16-11-13-17(14-12-16)18-7-3-4-8-19(18)24(28)29/h3-5,7-14H,2,6,15H2,1H3,(H,28,29)
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| InChIKey |
SQDPYYHUIAEALK-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