General Information of the Compound
| Compound ID |
CP0550314
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| Compound Name |
2-(4-amino-3-bromo-5-fluorophenyl)-2-(cyclohexylamino)ethanol;hydrochloride
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| Structure |
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| Formula |
C14H21BrClFN2O
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| Molecular Weight |
367.69
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| Canonical SMILES |
Cl.Nc1c(F)cc(cc1Br)C(CO)NC1CCCCC1
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| InChI |
InChI=1S/C14H20BrFN2O.ClH/c15-11-6-9(7-12(16)14(11)17)13(8-19)18-10-4-2-1-3-5-10;/h6-7,10,13,18-19H,1-5,8,17H2;1H
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| InChIKey |
QWJLNGIEMALHET-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