General Information of the Compound
| Compound ID |
CP0725880
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| Compound Name |
(6R,11S)-11-(3,4-dichlorophenyl)-2-oxa-8-azaspiro[5.5]undecane
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| Structure |
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| Formula |
C15H19Cl2NO
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| Molecular Weight |
300.229
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| Canonical SMILES |
Clc1ccc([C@@H]2CCNC[C@@]23CCCOC3)cc1Cl
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| InChI |
InChI=1S/C15H19Cl2NO/c16-13-3-2-11(8-14(13)17)12-4-6-18-9-15(12)5-1-7-19-10-15/h2-3,8,12,18H,1,4-7,9-10H2/t12-,15+/m0/s1
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| InChIKey |
FOZZHOLQHJQMRY-SWLSCSKDSA-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