7-OH-DPAT   

GtoPdb Ligand ID: 950

Synonyms: (+)-7-hydroxy-2-aminopropylaminotetralin | (+)7-OH-DPAT
Compound class: Synthetic organic
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 23.47
Molecular weight 247.19
XLogP 3.33
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES CCCN(C1CCc2c(C1)cc(cc2)O)CCC
Isomeric SMILES CCCN(C1CCc2c(C1)cc(cc2)O)CCC
InChI InChI=1S/C16H25NO/c1-3-9-17(10-4-2)15-7-5-13-6-8-16(18)12-14(13)11-15/h6,8,12,15,18H,3-5,7,9-11H2,1-2H3
InChI Key BLYMJBIZMIGWFK-UHFFFAOYSA-N
References
1. Burris KD, Pacheco MA, Filtz TM, Kung MP, Kung HF, Molinoff PB. (1995)
Lack of discrimination by agonists for D2 and D3 dopamine receptors.
Neuropsychopharmacology, 12 (4): 335-45. [PMID:7576010]
2. Chumpradit S, Kung MP, Vessotskie J, Foulon C, Mu M, Kung HF. (1994)
Iodinated 2-aminotetralins and 3-amino-1-benzopyrans: ligands for dopamine D2 and D3 receptors.
J. Med. Chem., 37 (24): 4245-50. [PMID:7990123]
3. Freedman SB, Patel S, Marwood R, Emms F, Seabrook GR, Knowles MR, McAllister G. (1994)
Expression and pharmacological characterization of the human D3 dopamine receptor.
J. Pharmacol. Exp. Ther., 268 (1): 417-26. [PMID:8301582]
4. MacKenzie RG, VanLeeuwen D, Pugsley TA, Shih YH, Demattos S, Tang L, Todd RD, O'Malley KL. (1994)
Characterization of the human dopamine D3 receptor expressed in transfected cell lines.
Eur. J. Pharmacol., 266 (1): 79-85. [PMID:7907989]
5. Sautel F, Griffon N, Lévesque D, Pilon C, Schwartz JC, Sokoloff P. (1995)
A functional test identifies dopamine agonists selective for D3versus D2receptors.
Neuroreport, 6: 329-332. [PMID:7756621]