General Information of the Compound
| Compound ID |
CP0000908
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| Compound Name |
1-(3-chlorophenyl)-2-(dimethylamino)propan-1-one
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| Synonyms |
1-(3-chlorophenyl)-2-(dimethylamino)propan-1-one
2-(N,N-Dimethylamino)-3''-chloropropiophenone
2-(N,N-Dimethylamino)-3'-chloropropiophenone
740079-95-2
AKOS009983839
BDBM50302908
CHEMBL566830
SCHEMBL769582
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| Structure |
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| Formula |
C11H14ClNO
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| Molecular Weight |
211.692
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| Canonical SMILES |
CC(N(C)C)C(=O)c1cccc(Cl)c1
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| InChI |
InChI=1S/C11H14ClNO/c1-8(13(2)3)11(14)9-5-4-6-10(12)7-9/h4-8H,1-3H3
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| InChIKey |
UYZAXUWVJGHEFL-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