General Information of the Compound
| Compound ID |
CP0367145
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| Compound Name |
2-[(1S)-5-[3-(2-propylphenoxy)propoxy]-2,3-dihydro-1H-inden-1-yl]acetic acid
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| Structure |
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| Formula |
C23H28O4
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| Molecular Weight |
368.473
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| Canonical SMILES |
CCCc1ccccc1OCCCOc1ccc2[C@H](CC(O)=O)CCc2c1
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| InChI |
InChI=1S/C23H28O4/c1-2-6-17-7-3-4-8-22(17)27-14-5-13-26-20-11-12-21-18(15-20)9-10-19(21)16-23(24)25/h3-4,7-8,11-12,15,19H,2,5-6,9-10,13-14,16H2,1H3,(H,24,25)/t19-/m0/s1
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| InChIKey |
YWWBTQCQZFKBMY-IBGZPJMESA-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