General Information of the Compound
| Compound ID |
CP0416729
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| Compound Name |
(R)-1-(3-Chloro-phenyl)-2-{(R)-2-[4-(2-hydroxy-ethoxy)-phenyl]-1-methyl-ethylamino}-ethanol
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| Structure |
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| Formula |
C19H24ClNO3
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| Molecular Weight |
349.858
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| Canonical SMILES |
C[C@H](Cc1ccc(OCCO)cc1)NC[C@H](O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C19H24ClNO3/c1-14(11-15-5-7-18(8-6-15)24-10-9-22)21-13-19(23)16-3-2-4-17(20)12-16/h2-8,12,14,19,21-23H,9-11,13H2,1H3/t14-,19+/m1/s1
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| InChIKey |
FSOBGMBQSLWEPZ-KUHUBIRLSA-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