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Compile Data Set for Download or QSAR

Found 66 hits Enz. Inhib. hit(s) with Target = 'Dopamine2-like' AND taxid = 10116   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine2-like


(RAT)
BDBM21397
PNG
(8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1
Show InChI InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)
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PubMed
0.0100n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50008735
PNG
((+)-3-(tert-butyl)-(3S,4aS,13bS)-2,3,4,4a,8,9,13b,...)
Show SMILES CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc4cccc([C@@H]2C1)c34
Show InChI InChI=1S/C25H31NO/c1-24(2,3)25(27)13-14-26-16-21-19-9-5-4-7-17(19)11-12-18-8-6-10-20(23(18)21)22(26)15-25/h4-10,21-22,27H,11-16H2,1-3H3/t21-,22-,25-/m0/s1
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0.0500n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50241107
PNG
(1-(3-(4-(5-chloro-2-oxo-2,3-dihydrobenzo[d]imidazo...)
Show SMILES Clc1ccc2n(C3CCN(CCCn4c5ccccc5[nH]c4=O)CC3)c(=O)[nH]c2c1
Show InChI InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)
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0.200n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM78433
PNG
(2-[4-[3-[2-(trifluoromethyl)-10-phenothiazinyl]pro...)
Show SMILES OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2
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0.25n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM79172
PNG
(2-[4-[(3Z)-3-[2-(trifluoromethyl)-9-thioxanthenyli...)
Show SMILES OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-
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0.25n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM79181
PNG
(10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoro...)
Show SMILES CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3
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0.410n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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0.440n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50132693
PNG
(4-Amino-N-(1-benzyl-piperidin-4-yl)-5-chloro-2-met...)
Show SMILES COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C20H24ClN3O2/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25)
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1.20n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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1.20n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50002338
PNG
((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...)
Show SMILES CSc1ccc2Sc3ccccc3N(CCC3CCCCN3C)c2c1
Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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6.40n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM85047
PNG
(SDZ GLC 756)
Show SMILES CN1C[C@H](CSc2ccccn2)C[C@@H]2Cc3c(O)cccc3C[C@@H]12
Show InChI InChI=1S/C20H24N2OS/c1-22-12-14(13-24-20-7-2-3-8-21-20)9-16-10-17-15(11-18(16)22)5-4-6-19(17)23/h2-8,14,16,18,23H,9-13H2,1H3/t14-,16-,18-/m1/s1
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7n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM21397
PNG
(8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1
Show InChI InChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)
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15n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86184
PNG
(Dinapsoline,(+/-)-4-Methyl)
Show SMILES Cc1ccc2Cc3c(O)c(O)ccc3[C@@H]3CNCc1c23
Show InChI InChI=1S/C17H17NO2/c1-9-2-3-10-6-12-11(4-5-15(19)17(12)20)14-8-18-7-13(9)16(10)14/h2-5,14,18-20H,6-8H2,1H3/t14-/m0/s1
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19n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86183
PNG
(Dinapsoline,(+/-)-4-Methyl-N-propyl)
Show SMILES CCCN1C[C@H]2c3ccc(O)c(O)c3Cc3ccc(C)c(C1)c23
Show InChI InChI=1S/C20H23NO2/c1-3-8-21-10-16-12(2)4-5-13-9-15-14(17(11-21)19(13)16)6-7-18(22)20(15)23/h4-7,17,22-23H,3,8-11H2,1-2H3/t17-/m0/s1
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21n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50005120
PNG
(CHEMBL274491 | N-((2S,3S)-1-Benzyl-2-methyl-pyrrol...)
Show SMILES CNc1cc(OC)c(cc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C
Show InChI InChI=1S/C21H26ClN3O2/c1-14-18(9-10-25(14)13-15-7-5-4-6-8-15)24-21(26)16-11-17(22)19(23-2)12-20(16)27-3/h4-8,11-12,14,18,23H,9-10,13H2,1-3H3,(H,24,26)/t14-,18-/m0/s1
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23n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50049047
PNG
(5,6,6a,7,8,12b-Hexahydro-benzo[a]phenanthridine-10...)
Show SMILES Oc1cc2CCC3NCc4ccccc4C3c2cc1O
Show InChI InChI=1S/C17H17NO2/c19-15-7-10-5-6-14-17(13(10)8-16(15)20)12-4-2-1-3-11(12)9-18-14/h1-4,7-8,14,17-20H,5-6,9H2
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24n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50117181
PNG
((S)-2,3,7,11b-Tetrahydro-1H-dibenzo[de,h]isoquinol...)
Show SMILES Oc1ccc2[C@@H]3CNCc4cccc(Cc2c1O)c34
Show InChI InChI=1S/C16H15NO2/c18-14-5-4-11-12(16(14)19)6-9-2-1-3-10-7-17-8-13(11)15(9)10/h1-5,13,17-19H,6-8H2/t13-/m0/s1
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25n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM78433
PNG
(2-[4-[3-[2-(trifluoromethyl)-10-phenothiazinyl]pro...)
Show SMILES OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2
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26n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM48320
PNG
(4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-metho...)
Show SMILES CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
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35n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM21398
PNG
(4-[4-(4-Chloro-phenyl)-4-hydroxy-piperidin-1-yl]-1...)
Show SMILES OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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39n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86177
PNG
(Dinapsoline,(+/-)-4-Methyl-N-allyl)
Show SMILES Cc1ccc2Cc3c(O)c(O)ccc3[C@@H]3CN(CC=C)Cc1c23
Show InChI InChI=1S/C20H21NO2/c1-3-8-21-10-16-12(2)4-5-13-9-15-14(17(11-21)19(13)16)6-7-18(22)20(15)23/h3-7,17,22-23H,1,8-11H2,2H3/t17-/m0/s1
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49n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86186
PNG
(Dinapsoline,(+/-)-6-Methyl)
Show SMILES Cc1ccc2CNC[C@H]3c4ccc(O)c(O)c4Cc1c23
Show InChI InChI=1S/C17H17NO2/c1-9-2-3-10-7-18-8-14-11-4-5-15(19)17(20)13(11)6-12(9)16(10)14/h2-5,14,18-20H,6-8H2,1H3/t14-/m0/s1
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57n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50091032
PNG
(6,7-Dihydroxy-1,2,3,4-tetrahydro-naphthalen-2-yl-a...)
Show SMILES [NH3+][C@@H]1CCc2cc(O)c(O)cc2C1
Show InChI InChI=1S/C10H13NO2/c11-8-2-1-6-4-9(12)10(13)5-7(6)3-8/h4-5,8,12-13H,1-3,11H2/p+1/t8-/m1/s1
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59n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86178
PNG
((+/-)-2-propyldinapsoline hydrobromide | Dinapsoli...)
Show SMILES CCCN1C[C@H]2c3ccc(O)c(O)c3Cc3cccc(C1)c23
Show InChI InChI=1S/C19H21NO2/c1-2-8-20-10-13-5-3-4-12-9-15-14(16(11-20)18(12)13)6-7-17(21)19(15)22/h3-7,16,21-22H,2,8-11H2,1H3/t16-/m0/s1
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60n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM81993
PNG
(BROMOCRIPTINE | Bromocriptine+ (GTP+) | Bromocript...)
Show SMILES CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c(Br)[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C
Show InChI InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23-,24+,25+,31-,32+/m1/s1
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68n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50020192
PNG
(8-(2,3-Dihydro-benzo[1,4]dioxin-2-ylmethyl)-1-phen...)
Show SMILES O=C1NCN(c2ccccc2)C11CCN(CC2COc3ccccc3O2)CC1
Show InChI InChI=1S/C22H25N3O3/c26-21-22(25(16-23-21)17-6-2-1-3-7-17)10-12-24(13-11-22)14-18-15-27-19-8-4-5-9-20(19)28-18/h1-9,18H,10-16H2,(H,23,26)
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68n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM22869
PNG
(6-chloro-10-(4-methylpiperazin-1-yl)-2,9-diazatric...)
Show SMILES CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3
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88n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM86185
PNG
(Dinapsoline,(+/-)-N-allyl)
Show SMILES Oc1ccc2[C@@H]3CN(CC=C)Cc4cccc(Cc2c1O)c34
Show InChI InChI=1S/C19H19NO2/c1-2-8-20-10-13-5-3-4-12-9-15-14(16(11-20)18(12)13)6-7-17(21)19(15)22/h2-7,16,21-22H,1,8-11H2/t16-/m0/s1
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110n/an/an/an/an/an/an/an/a



Purdue University

Curated by PDSP Ki Database




Bioorg Med Chem 11: 1451-64 (2003)

More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50002338
PNG
((Thioridazine)10-[2-(1-Methyl-piperidin-2-yl)-ethy...)
Show SMILES CSc1ccc2Sc3ccccc3N(CCC3CCCCN3C)c2c1
Show InChI InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3
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160n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM55121
PNG
(3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...)
Show SMILES NCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2
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192n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM81493
PNG
(CAS_749-13-3 | TRIFLUORPERIDOL)
Show SMILES OC1(CCN(CC1)C(F)CCC(=O)c1ccccc1)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C22H23F4NO2/c23-20(10-9-19(28)16-5-2-1-3-6-16)27-13-11-21(29,12-14-27)17-7-4-8-18(15-17)22(24,25)26/h1-8,15,20,29H,9-14H2
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200n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50001888
PNG
((chloropromazine) [3-(2-Chloro-phenothiazin-10-yl)...)
Show SMILES CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
Show InChI InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
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210n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM82479
PNG
(CAS_132539-06-1 | NSC_4585 | OLANZAPINE)
Show SMILES CN1CCN(CC1)C1=c2cc(C)sc2=Nc2ccccc2N1
Show InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,18H,7-10H2,1-2H3
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220n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM81444
PNG
(CAS_185453 | NSC_185453 | WB 4101)
Show SMILES COc1cccc(OC)c1OCCNCC1Oc2ccccc2OC1c1ccccc1
Show InChI InChI=1S/C25H27NO5/c1-27-21-13-8-14-22(28-2)25(21)29-16-15-26-17-23-24(18-9-4-3-5-10-18)31-20-12-7-6-11-19(20)30-23/h3-14,23-24,26H,15-17H2,1-2H3
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237n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50130290
PNG
(3-Ethyl-2-methyl-5-morpholin-4-ylmethyl-1,5,6,7-te...)
Show SMILES CCc1c(C)[nH]c2CCC(CN3CCOCC3)C(=O)c12
Show InChI InChI=1S/C16H24N2O2/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18/h12,17H,3-10H2,1-2H3
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270n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50026957
PNG
((cis) 2-{4-[3-(2-Trifluoromethyl-thioxanthen-9-yli...)
Show SMILES OCCN1CCN(CC\C=C2/c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5+
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300n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM22869
PNG
(6-chloro-10-(4-methylpiperazin-1-yl)-2,9-diazatric...)
Show SMILES CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1
Show InChI InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3
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420n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM84342
PNG
(4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol...)
Show SMILES CNCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3
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427n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50007422
PNG
((+)-6-Propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]q...)
Show SMILES CCCN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31
Show InChI InChI=1S/C19H21NO2/c1-2-9-20-10-8-12-4-3-5-14-17(12)15(20)11-13-6-7-16(21)19(22)18(13)14/h3-7,15,21-22H,2,8-11H2,1H3/t15-/m1/s1
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460n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM82247
PNG
(8-Chloro-3-methyl-5-phenyl-2,3,4,5-tetrahydro-1H-b...)
Show SMILES CN1CCc2cc(Cl)c(O)cc2[C@H](C1)c1ccccc1
Show InChI InChI=1S/C17H18ClNO/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12/h2-6,9-10,15,20H,7-8,11H2,1H3/t15-/m1/s1
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569n/an/an/an/an/an/an/an/a



University of North Texas

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM21395
PNG
(3-(2-(4-(4-Fluorobenzoyl)piperidinol)ethyl)-2,4(1H...)
Show SMILES Fc1ccc(cc1)C(=O)C1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1
Show InChI InChI=1S/C22H22FN3O3/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29/h1-8,16H,9-14H2,(H,24,29)
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775n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM79181
PNG
(10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoro...)
Show SMILES CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
Show InChI InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3
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850n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM81486
PNG
(CAS_1050-79-9 | MOPERONE | NSC_4249)
Show SMILES Cc1ccc(cc1)C1(O)CCN(CCCC(=O)c2ccc(F)cc2)CC1
Show InChI InChI=1S/C22H26FNO2/c1-17-4-8-19(9-5-17)22(26)12-15-24(16-13-22)14-2-3-21(25)18-6-10-20(23)11-7-18/h4-11,26H,2-3,12-16H2,1H3
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880n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50005118
PNG
((S)-3,5-Dichloro-N-(1-ethyl-pyrrolidin-2-ylmethyl)...)
Show SMILES CCN1CCC[C@H]1CNC(=O)c1c(O)c(Cl)cc(Cl)c1OC
Show InChI InChI=1S/C15H20Cl2N2O3/c1-3-19-6-4-5-9(19)8-18-15(21)12-13(20)10(16)7-11(17)14(12)22-2/h7,9,20H,3-6,8H2,1-2H3,(H,18,21)/t9-/m0/s1
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880n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50013515
PNG
((+)-yohimbine | (16alpha,17alpha)-17-hydroxyyohimb...)
Show SMILES COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
Show InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1
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926n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM85046
PNG
(Aminotetralin-6,7-dihydroxy-(-))
Show SMILES N[C@H]1CCc2cc(O)c(O)cc2C1
Show InChI InChI=1S/C10H13NO2/c11-8-2-1-6-4-9(12)10(13)5-7(6)3-8/h4-5,8,12-13H,1-3,11H2/t8-/m0/s1
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930n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50033112
PNG
(6-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propyla...)
Show SMILES COc1ccccc1N1CCN(CCCNc2c(C)c(=O)n(C)c(=O)n2C)CC1
Show InChI InChI=1S/C21H31N5O3/c1-16-19(23(2)21(28)24(3)20(16)27)22-10-7-11-25-12-14-26(15-13-25)17-8-5-6-9-18(17)29-4/h5-6,8-9,22H,7,10-15H2,1-4H3
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969n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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1.11E+3n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM50001859
PNG
((buspirone) 8-[4-(4-Pyrimidin-2-yl-piperazin-1-yl)...)
Show SMILES O=C1CC2(CCCC2)CC(=O)N1CCCCN1CCN(CC1)c1ncccn1
Show InChI InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2
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1.21E+3n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
Dopamine2-like


(RAT)
BDBM30712
PNG
(6-tert-butyl-3-(2-imidazolin-2-ylmethyl)-2,4-dimet...)
Show SMILES Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C
Show InChI InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)
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1.26E+3n/an/an/an/an/an/an/an/a



University of Toronto

Curated by PDSP Ki Database




Citation and Details
More data for this
Ligand-Target Pair
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