General Information of the Compound
| Compound ID |
CP0888285
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| Compound Name |
7-((1R,2S)-2-(4-(2-hydroxyhexyl)phenyl)-5-oxocyclopentyl)heptanoic acid
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| Structure |
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| Formula |
C24H36O4
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| Molecular Weight |
388.548
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| Canonical SMILES |
CCCCC(O)Cc1ccc([C@H]2CCC(=O)[C@@H]2CCCCCCC(=O)O)cc1
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| InChI |
InChI=1S/C24H36O4/c1-2-3-8-20(25)17-18-11-13-19(14-12-18)21-15-16-23(26)22(21)9-6-4-5-7-10-24(27)28/h11-14,20-22,25H,2-10,15-17H2,1H3,(H,27,28)/t20?,21-,22-/m1/s1
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| InChIKey |
AFVFPGBVTXFYMQ-HRUVVLKGSA-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