General Information of the Compound
| Compound ID |
CP0563722
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| Compound Name |
(2S)-4-[(5-methoxy-1H-indol-3-yl)methyl]-2-(phenoxymethyl)morpholine
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| Structure |
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| Formula |
C21H24N2O3
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| Molecular Weight |
352.434
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| Canonical SMILES |
COc1ccc2[nH]cc(CN3CCO[C@H](COc4ccccc4)C3)c2c1
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| InChI |
InChI=1S/C21H24N2O3/c1-24-18-7-8-21-20(11-18)16(12-22-21)13-23-9-10-25-19(14-23)15-26-17-5-3-2-4-6-17/h2-8,11-12,19,22H,9-10,13-15H2,1H3/t19-/m0/s1
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| InChIKey |
SSAGPRNCPKPHLK-IBGZPJMESA-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