General Information of the Compound
| Compound ID |
CP0575568
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| Compound Name |
(1S,3S)-7-chloro-3-(methoxymethyl)-1-phenyl-1,2,3,4-tetrahydroisoquinoline
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| Structure |
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| Formula |
C17H18ClNO
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| Molecular Weight |
287.79
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| Canonical SMILES |
COC[C@@H]1Cc2ccc(Cl)cc2[C@@H](N1)c1ccccc1
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| InChI |
InChI=1S/C17H18ClNO/c1-20-11-15-9-13-7-8-14(18)10-16(13)17(19-15)12-5-3-2-4-6-12/h2-8,10,15,17,19H,9,11H2,1H3/t15-,17-/m0/s1
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| InChIKey |
UHNHVSWGQSLZHA-RDJZCZTQSA-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