General Information of the Compound
| Compound ID |
CP0519647
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| Compound Name |
[5-hydroxy-1-(oxolan-3-ylmethyl)indol-3-yl]-(4-methoxyphenyl)methanone
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| Structure |
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| Formula |
C21H21NO4
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| Molecular Weight |
351.402
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| Canonical SMILES |
COc1ccc(cc1)C(=O)c1cn(CC2CCOC2)c2ccc(O)cc12
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| InChI |
InChI=1S/C21H21NO4/c1-25-17-5-2-15(3-6-17)21(24)19-12-22(11-14-8-9-26-13-14)20-7-4-16(23)10-18(19)20/h2-7,10,12,14,23H,8-9,11,13H2,1H3
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| InChIKey |
HOGDOVSQOPDZSR-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