General Information of the Compound
| Compound ID |
CP0500448
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| Compound Name |
2-[(1S)-5-{3-[(3-methyl-1,2-benzoxazol-6-yl)oxy]propoxy}-2,3-dihydro-1H-inden-1-yl]acetic acid
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| Structure |
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| Formula |
C22H23NO5
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| Molecular Weight |
381.428
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| Canonical SMILES |
Cc1noc2cc(OCCCOc3ccc4[C@H](CC(O)=O)CCc4c3)ccc12
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| InChI |
InChI=1S/C22H23NO5/c1-14-19-7-5-18(13-21(19)28-23-14)27-10-2-9-26-17-6-8-20-15(11-17)3-4-16(20)12-22(24)25/h5-8,11,13,16H,2-4,9-10,12H2,1H3,(H,24,25)/t16-/m0/s1
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| InChIKey |
OSVNFBIFFWEZCZ-INIZCTEOSA-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