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GABAA受体
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右旋比扣扣灵碱分子式: C20H17NO6 分子量: 367.35IUPAC Name: (6R)-6-[(5S)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-oneSMILES: CN1CCC2=CC3=C(C=C2C1C4C5=C(C6=C(C=C5)OCO6)C(=O)O4)OCO3InChIKey: IYGYMKDQCDOMRE-ZWKOTPCHSA-NInChI: InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18+/m0/s1
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氟马西尼CAS号 : 78755-81-4 Compound CID : 3373分子式: C15H14FN3O3 分子量: 303.29IUPAC Name: ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylateSMILES: CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)CInChIKey: OFBIFZUFASYYRE-UHFFFAOYSA-NInChI: InChI=1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3
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呋塞米分子式: C12H11ClN2O5S 分子量: 330.74IUPAC Name: 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoic acidSMILES: C1=COC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)ClInChIKey: ZZUFCTLCJUWOSV-UHFFFAOYSA-NInChI: InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)
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TPMPA,GABAA-ρ拮抗剂CAS号 : 182485-36-5 Compound CID : 5521分子式: C6H12NO2P 分子量: 161.14IUPAC Name: methyl(1,2,3,6-tetrahydropyridin-4-yl)phosphinic acidSMILES: CP(=O)(C1=CCNCC1)OInChIKey: MFUKVPOVVKKLRQ-UHFFFAOYSA-NInChI: InChI=1S/C6H12NO2P/c1-10(8,9)6-2-4-7-5-3-6/h2,7H,3-5H2,1H3,(H,8,9)
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TP 003,GABAA部分激动剂CAS号 : 628690-75-5 Compound CID : 10001434分子式: C23H16F3N3O 分子量: 407.39IUPAC Name: 5-fluoro-2-[2-fluoro-5-[8-fluoro-7-(2-hydroxypropan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]benzonitrileSMILES: CC(C)(C1=C(C2=NC=C(N2C=C1)C3=CC(=C(C=C3)F)C4=C(C=C(C=C4)F)C#N)F)OInChIKey: SJMMDWXJSSJHOQ-UHFFFAOYSA-NInChI: InChI=1S/C23H16F3N3O/c1-23(2,30)18-7-8-29-20(12-28-22(29)21(18)26)13-3-6-19(25)17(10-13)16-5-4-15(24)9-14(16)11-27/h3-10,12,30H,1-2H3
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Ro 15-4513,苯二氮卓类部分反向激动剂CAS号 : 91917-65-6 Compound CID : 5081分子式: C15H14N6O3 分子量: 326.31IUPAC Name: ethyl 8-azido-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylateSMILES: CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)N=[N+]=[N-])CInChIKey: CFSOJZTUTOQNIA-UHFFFAOYSA-NInChI: InChI=1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3
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PZ-II-029,α6β3γ2-GABAA正构变构调节剂CAS号 : 164025-44-9 Compound CID : 10426200分子式: C18H15N3O3 分子量: 321.33IUPAC Name: 7-methoxy-2-(4-methoxyphenyl)-1H-pyrazolo[4,3-c]quinolin-3-oneSMILES: COC1=CC=C(C=C1)N2C(=O)C3=CN=C4C=C(C=CC4=C3N2)OCInChIKey: CGOOCGJMECBDCB-UHFFFAOYSA-NInChI: InChI=1S/C18H15N3O3/c1-23-12-5-3-11(4-6-12)21-18(22)15-10-19-16-9-13(24-2)7-8-14(16)17(15)20-21/h3-10,20H,1-2H3
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奥西普隆CAS号 : 96604-21-6 Compound CID : 216456分子式: C17H11N5O 分子量: 301.3IUPAC Name: pyridin-2-yl-(7-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanoneSMILES: C1=CC=NC(=C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=NC=C4InChIKey: OQJFBUOFGHPMSR-UHFFFAOYSA-NInChI: InChI=1S/C17H11N5O/c23-16(14-3-1-2-7-19-14)13-11-21-22-15(6-10-20-17(13)22)12-4-8-18-9-5-12/h1-11H
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MRK 016,α5-GABAA反向激动剂CAS号 : 342652-67-9 Compound CID : 6918583分子式: C17H20N8O2 分子量: 368.39IUPAC Name: 3-[3-tert-butyl-2-[(2-methyl-1,2,4-triazol-3-yl)methoxy]pyrazolo[1,5-d][1,2,4]triazin-7-yl]-5-methyl-1,2-oxazoleSMILES: CC1=CC(=NO1)C2=NN=CC3=C(C(=NN32)OCC4=NC=NN4C)C(C)(C)CInChIKey: QYSYOGCIDRANAR-UHFFFAOYSA-NInChI: InChI=1S/C17H20N8O2/c1-10-6-11(23-27-10)15-21-19-7-12-14(17(2,3)4)16(22-25(12)15)26-8-13-18-9-20-24(13)5/h6-7,9H,8H2,1-5H3
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Indiplon,GABAA的正构构调节剂CAS号 : 325715-02-4 Compound CID : 6450813分子式: C20H16N4O2S 分子量: 376.43IUPAC Name: N-methyl-N-[3-[3-(thiophene-2-carbonyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]acetamideSMILES: CC(=O)N(C)C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C(=O)C4=CC=CS4InChIKey: CBIAWPMZSFFRGN-UHFFFAOYSA-NInChI: InChI=1S/C20H16N4O2S/c1-13(25)23(2)15-6-3-5-14(11-15)17-8-9-21-20-16(12-22-24(17)20)19(26)18-7-4-10-27-18/h3-12H,1-2H3
