General Information of the Compound
| Compound ID |
CP0564675
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| Compound Name |
[5-chloro-2-[[(2R)-2-hydroxy-3-(2-methoxyphenoxy)propyl]amino]phenyl]-phenylmethanone
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| Structure |
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| Formula |
C23H22ClNO4
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| Molecular Weight |
411.885
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| Canonical SMILES |
COc1ccccc1OC[C@H](O)CNc1ccc(Cl)cc1C(=O)c1ccccc1
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| InChI |
InChI=1S/C23H22ClNO4/c1-28-21-9-5-6-10-22(21)29-15-18(26)14-25-20-12-11-17(24)13-19(20)23(27)16-7-3-2-4-8-16/h2-13,18,25-26H,14-15H2,1H3/t18-/m1/s1
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| InChIKey |
NUEYNCYZLMDDHY-GOSISDBHSA-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