General Information of the Compound
| Compound ID |
CP0406194
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| Compound Name |
1-(2-isopropylphenoxy)-3-morpholinopropan-2-ol
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| Synonyms |
1-(2-isopropylphenoxy)-3-morpholinopropan-2-ol
1-morpholin-4-yl-3-(2-propan-2-ylphenoxy)propan-2-ol
AC1N31P0
BDBM50318979
CHEMBL1083668
Oprea1_740178
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| Structure |
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| Formula |
C16H25NO3
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| Molecular Weight |
279.38
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| Canonical SMILES |
CC(C)c1ccccc1OCC(O)CN1CCOCC1
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| InChI |
InChI=1S/C16H25NO3/c1-13(2)15-5-3-4-6-16(15)20-12-14(18)11-17-7-9-19-10-8-17/h3-6,13-14,18H,7-12H2,1-2H3
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| InChIKey |
OFEYQVJHAZFCJS-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
Protein ID: PT01179, Beta-1 adrenergic receptor
Protein ID: PT01494, Beta-2 adrenergic receptor
Protein ID: PT01493, Beta-3 adrenergic receptor
Clinical Information about the Compound