General Information of the Compound
| Compound ID |
CP0418667
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| Compound Name |
1-(4-amino-3,5-dichlorophenyl)-2-(1-(4-isopropylphenyl)-2-methylpropan-2-ylamino)ethanol
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| Structure |
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| Formula |
C21H28Cl2N2O
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| Molecular Weight |
395.374
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| Canonical SMILES |
CC(C)c1ccc(CC(C)(C)NCC(O)c2cc(Cl)c(N)c(Cl)c2)cc1
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| InChI |
InChI=1S/C21H28Cl2N2O/c1-13(2)15-7-5-14(6-8-15)11-21(3,4)25-12-19(26)16-9-17(22)20(24)18(23)10-16/h5-10,13,19,25-26H,11-12,24H2,1-4H3
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| InChIKey |
WURWPCGAPCARMP-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