General Information of the Compound
| Compound ID |
CP0389246
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| Compound Name |
2-[(2S)-1-[4-(2-phenylphenoxy)phenyl]pyrrolidin-2-yl]acetic acid
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| Structure |
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| Formula |
C24H23NO3
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| Molecular Weight |
373.452
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| Canonical SMILES |
OC(=O)C[C@@H]1CCCN1c1ccc(Oc2ccccc2-c2ccccc2)cc1
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| InChI |
InChI=1S/C24H23NO3/c26-24(27)17-20-9-6-16-25(20)19-12-14-21(15-13-19)28-23-11-5-4-10-22(23)18-7-2-1-3-8-18/h1-5,7-8,10-15,20H,6,9,16-17H2,(H,26,27)/t20-/m0/s1
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| InChIKey |
VCRBEUNVVAEWLK-FQEVSTJZSA-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
Protein ID: PT04613, Free fatty acid receptor 1
Protein ID: PT02793, Free fatty acid receptor 1