General Information of the Compound
| Compound ID |
CP0500651
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| Compound Name |
(R)-2-chloro-6-(2-hydroxy-3-(2-(naphthalen-2-yl)ethylamino)propoxy)benzonitrile
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| Structure |
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| Formula |
C22H21ClN2O2
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| Molecular Weight |
380.875
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| Canonical SMILES |
O[C@H](CNCCc1ccc2ccccc2c1)COc1cccc(Cl)c1C#N
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| InChI |
InChI=1S/C22H21ClN2O2/c23-21-6-3-7-22(20(21)13-24)27-15-19(26)14-25-11-10-16-8-9-17-4-1-2-5-18(17)12-16/h1-9,12,19,25-26H,10-11,14-15H2/t19-/m1/s1
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| InChIKey |
SLUDXVDILMLNPE-LJQANCHMSA-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