General Information of the Compound
| Compound ID |
CP0000011
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| Compound Name |
2-(N-Cyclopentylamino)-3'-methoxypropiophenone
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| Synonyms |
2-(N-Cyclopentylamino)-3'-methoxypropiophenone
BDBM50308121
CHEMBL589250
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| Structure |
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| Formula |
C15H21NO2
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| Molecular Weight |
247.338
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| Canonical SMILES |
COc1cccc(c1)C(=O)C(C)NC1CCCC1
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| InChI |
InChI=1S/C15H21NO2/c1-11(16-13-7-3-4-8-13)15(17)12-6-5-9-14(10-12)18-2/h5-6,9-11,13,16H,3-4,7-8H2,1-2H3
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| InChIKey |
ZMRXSORFBXMBCB-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
Clinical Information about the Compound