General Information of the Compound
| Compound ID |
CP0438758
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| Compound Name |
5-(4-Chloro-phenyl)-9-methoxy-2,5-dihydro-3H-imidazo[2,1-a]isoindol-5-ol
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| Structure |
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| Formula |
C17H15ClN2O2
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| Molecular Weight |
314.772
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| Canonical SMILES |
COc1cccc2c1C1=NCCN1C2(O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H15ClN2O2/c1-22-14-4-2-3-13-15(14)16-19-9-10-20(16)17(13,21)11-5-7-12(18)8-6-11/h2-8,21H,9-10H2,1H3
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| InChIKey |
JIVIBEFNFXNPFI-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
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter