激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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GSK3787,不可逆的PPARδ拮抗剂
- ≥98%
CAS号 : 188591-46-0 Compound CID : 2800647

分子式: C₁₅H₁₂ClF₃N₂O₃S 分子量: 392.78

IUPAC Name: 4-chloro-N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl]benzamide

SMILES: C1=CC(=CC=C1C(=O)NCCS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F)Cl

InChIKey: JFUIMTGOQCQTPF-UHFFFAOYSA-N

InChI: InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22)
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AT7519
- 10mM in DMSO
CAS号 : 844442-38-2(DMSO)

分子式: C₁₆H₁₇Cl₂N₅O₂ 分子量: 382.24

SMILES: ClC1=CC=CC(=C1C(=O)NC2=C[NH]N=C2C(=O)NC3CCNCC3)Cl
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Elafibranor
- 10mM in DMSO
CAS号 : 923978-27-2(DMSO)

分子式: C₂₂H₂₄O₄S 分子量: 384.49

SMILES: CSC1=CC=C(C=C1)C(=O)\C=C\C2=CC(=C(OC(C)(C)C(O)=O)C(=C2)C)C
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GSK3787
- 10mM in DMSO
CAS号 : 188591-46-0(DMSO)

分子式: C₁₅H₁₂ClF₃N₂O₃S 分子量: 392.78

SMILES: FC(F)(F)C1=CC=C(N=C1)[S](=O)(=O)CCNC(=O)C2=CC=C(Cl)C=C2
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GW0742
- 10mM in DMSO
CAS号 : 317318-84-6(DMSO)

分子式: C₂₁H₁₇F₄NO₃S₂ 分子量: 471.49

SMILES: CC1=CC(=CC=C1OCC(O)=O)SCC2=C(C)N=C(S2)C3=CC=C(C(=C3)F)C(F)(F)F
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瑞博西利
- 10mM in DMSO
CAS号 : 1211441-98-3(DMSO)

分子式: C₂₃H₃₀N₈O 分子量: 434.54

SMILES: CN(C)C(=O)C1=CC2=CN=C(NC3=NC=C(C=C3)N4CCNCC4)N=C2[N]1C5CCCC5
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维生素A酸
- 10mM in DMSO
CAS号 : 302-79-4(DMSO)

分子式: C₂₀H₂₈O₂ 分子量: 300.4

SMILES: CC1=C(\C=C\C(C)=C\C=C\C(C)=C\C(O)=O)C(C)(C)CCC1
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MA-0204
- ≥98%
CAS号 : 2095128-17-7 Compound CID : 126752361

分子式: C₂₅H₂₇F₃N₂O₄ 分子量: 476.49

IUPAC Name: (3R)-3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethoxy)phenyl]imidazol-1-yl]methyl]phenoxy]hexanoic acid

SMILES: CC1=CN=C(N1CC2=CC=CC=C2OCCCC(C)CC(=O)O)C3=CC=C(C=C3)OC(F)(F)F

InChIKey: GYNMVDMBFKGCCR-QGZVFWFLSA-N

InChI: InChI=1S/C25H27F3N2O4/c1-17(14-23(31)32)6-5-13-33-22-8-4-3-7-20(22)16-30-18(2)15-29-24(30)19-9-11-21(12-10-19)34-25(26,27)28/h3-4,7-12,15,17H,5-6,13-14,16H2,1-2H3,(H,31,32)/t17-/m1/s1
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BSJ-03-123
- 10mM in DMSO
CAS号 : 2361493-16-3 Compound CID : 137628658

分子式: C₄₇H₅₆N₁₀O₁₁ 分子量: 937.02

IUPAC Name: N-[2-[2-[2-[2-[4-[6-[(6-acetyl-8-cyclopentyl-5-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]pyridin-3-yl]piperazin-1-yl]ethoxy]ethoxy]ethoxy]ethyl]-2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetamide

SMILES: CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)N4CCN(CC4)CCOCCOCCOCCNC(=O)COC5=CC=CC6=C5C(=O)N(C6=O)C7CCC(=O)NC7=O)C8CCCC8)C(=O)C

InChIKey: LUHCYAOYQIFNRN-UHFFFAOYSA-N

InChI: InChI=1S/C47H56N10O11/c1-29-34-27-50-47(53-42(34)56(31-6-3-4-7-31)45(63)40(29)30(2)58)51-37-12-10-32(26-49-37)55-17-15-54(16-18-55)19-21-66-23-25-67-24-22-65-20-14-48-39(60)28-68-36-9-5-8-33-41(36)46(64)57(44(33)62)35-11-13-38(59)52-43(35)61/h5,8-10,12,26-27,31,35H,3-4,6-7,11,13-25,28H2,1-2H3,(H,48,60)(H,52,59,61)(H,49,50,51,53)
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GSK0660
- 10mM in DMSO
CAS号 : 1014691-61-2 Compound CID : 46233311

分子式: C₁₉H₁₈N₂O₅S₂ 分子量: 418.49

IUPAC Name: methyl 3-[(4-anilino-2-methoxyphenyl)sulfamoyl]thiophene-2-carboxylate

SMILES: COC1=C(C=CC(=C1)NC2=CC=CC=C2)NS(=O)(=O)C3=C(SC=C3)C(=O)OC

InChIKey: NDFKBGWLUHKMFY-UHFFFAOYSA-N

InChI: InChI=1S/C19H18N2O5S2/c1-25-16-12-14(20-13-6-4-3-5-7-13)8-9-15(16)21-28(23,24)17-10-11-27-18(17)19(22)26-2/h3-12,20-21H,1-2H3
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G1T38
- 2mM in DMSO
CAS号 : 1628256-23-4 Compound CID : 86269224

分子式: C₂₆H₃₄N₈O 分子量: 474.6

IUPAC Name: 4-[[5-(4-propan-2-ylpiperazin-1-yl)pyridin-2-yl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one

SMILES: CC(C)N1CCN(CC1)C2=CN=C(C=C2)NC3=NC=C4C=C5C(=O)NCC6(N5C4=N3)CCCCC6

InChIKey: YPJRHEKCFKOVRT-UHFFFAOYSA-N

InChI: InChI=1S/C26H34N8O/c1-18(2)32-10-12-33(13-11-32)20-6-7-22(27-16-20)30-25-28-15-19-14-21-24(35)29-17-26(8-4-3-5-9-26)34(21)23(19)31-25/h6-7,14-16,18H,3-5,8-13,17H2,1-2H3,(H,29,35)(H,27,28,30,31)
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GW501516
- 10mM in DMSO
CAS号 : 317318-70-0 Compound CID : 9803963

分子式: C₂₁H₁₈F₃NO₃S₂ 分子量: 453.5

IUPAC Name: 2-[2-methyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]acetic acid

SMILES: CC1=C(C=CC(=C1)SCC2=C(N=C(S2)C3=CC=C(C=C3)C(F)(F)F)C)OCC(=O)O

InChIKey: YDBLKRPLXZNVNB-UHFFFAOYSA-N

InChI: InChI=1S/C21H18F3NO3S2/c1-12-9-16(7-8-17(12)28-10-19(26)27)29-11-18-13(2)25-20(30-18)14-3-5-15(6-4-14)21(22,23)24/h3-9H,10-11H2,1-2H3,(H,26,27)
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