General Information of the Compound
| Compound ID |
CP0406756
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| Compound Name |
[3-(2-hydroxyethyl)azetidin-1-yl]-(1H-indol-2-yl)methanone
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| Structure |
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| Formula |
C14H16N2O2
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| Molecular Weight |
244.294
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| Canonical SMILES |
OCCC1CN(C1)C(=O)c1cc2ccccc2[nH]1
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| InChI |
InChI=1S/C14H16N2O2/c17-6-5-10-8-16(9-10)14(18)13-7-11-3-1-2-4-12(11)15-13/h1-4,7,10,15,17H,5-6,8-9H2
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| InChIKey |
RPMNSNSYZJANOY-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