General Information of the Compound
| Compound ID |
CP0067545
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| Compound Name |
1-(1-Benzyl-1,2,3,4-tetrahydroquinolin-6-yloxy)-3-isopropylaminopropan-2-ol
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| Structure |
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| Formula |
C22H30N2O2
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| Molecular Weight |
354.494
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| Canonical SMILES |
CC(C)NCC(O)COc1ccc2N(Cc3ccccc3)CCCc2c1
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| InChI |
InChI=1S/C22H30N2O2/c1-17(2)23-14-20(25)16-26-21-10-11-22-19(13-21)9-6-12-24(22)15-18-7-4-3-5-8-18/h3-5,7-8,10-11,13,17,20,23,25H,6,9,12,14-16H2,1-2H3
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| InChIKey |
JUVWASPQEPNQTK-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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