General Information of the Compound
| Compound ID |
CP0575157
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| Compound Name |
methyl 4-(2,3-dihydroindol-1-yl)-4-oxobutanoate
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| Structure |
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| Formula |
C13H15NO3
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| Molecular Weight |
233.267
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| Canonical SMILES |
COC(=O)CCC(=O)N1CCc2ccccc12
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| InChI |
InChI=1S/C13H15NO3/c1-17-13(16)7-6-12(15)14-9-8-10-4-2-3-5-11(10)14/h2-5H,6-9H2,1H3
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| InChIKey |
AYMVNVWATJUROX-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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