General Information of the Compound
| Compound ID |
CP0475197
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| Compound Name |
1-(2-(3-(diisopropylamino)-2-hydroxypropoxy)phenyl)-3-(naphthalen-1-yl)propan-1-one
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| Structure |
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| Formula |
C28H35NO3
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| Molecular Weight |
433.592
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| Canonical SMILES |
CC(C)N(CC(O)COc1ccccc1C(=O)CCc1cccc2ccccc12)C(C)C
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| InChI |
InChI=1S/C28H35NO3/c1-20(2)29(21(3)4)18-24(30)19-32-28-15-8-7-14-26(28)27(31)17-16-23-12-9-11-22-10-5-6-13-25(22)23/h5-15,20-21,24,30H,16-19H2,1-4H3
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| InChIKey |
UXLNGOOPOYAJCH-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