小分子
选项
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PrucaloprideCAS号 : 179474-81-8(DMSO)分子式: C18H26ClN3O3 分子量: 367.87SMILES: COCCCN1CCC(CC1)NC(=O)C2=CC(=C(N)C3=C2OCC3)Cl
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尼氟酸CAS号 : 4394-00-7(DMSO)分子式: C13H9F3N2O2 分子量: 282.22SMILES: OC(=O)C1=CC=CN=C1NC2=CC=CC(=C2)C(F)(F)F
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舒林酸CAS号 : 38194-50-2(DMSO)分子式: C20H17FO3S 分子量: 356.41SMILES: CC1=C(CC(O)=O)C2=C(C=CC(=C2)F)\C1=C/C3=CC=C(C=C3)[S](C)=O
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AuranofinCAS号 : 34031-32-8分子式: C20H34AuO9PS 分子量: 678.48IUPAC Name: gold(1+);3,4,5-triacetyloxy-6-(acetyloxymethyl)oxane-2-thiolate;triethylphosphaneSMILES: CCP(CC)CC.CC(=O)OCC1C(C(C(C(O1)[S-])OC(=O)C)OC(=O)C)OC(=O)C.[Au+]InChIKey: AUJRCFUBUPVWSZ-UHFFFAOYSA-MInChI: InChI=1S/C14H20O9S.C6H15P.Au/c1-6(15)19-5-10-11(20-7(2)16)12(21-8(3)17)13(14(24)23-10)22-9(4)18;1-4-7(5-2)6-3;/h10-14,24H,5H2,1-4H3;4-6H2,1-3H3;/q;;+1/p-1
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卡洛芬CAS号 : 53716-49-7分子式: C15H12ClNO2 分子量: 273.72IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acidSMILES: CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)OInChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-NInChI: InChI=1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
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甲氧氯普胺CAS号 : 364-62-5分子式: C14H22ClN3O2 分子量: 299.8IUPAC Name: 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamideSMILES: CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)ClInChIKey: TTWJBBZEZQICBI-UHFFFAOYSA-NInChI: 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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奥沙普秦CAS号 : 21256-18-8分子式: C18H15NO3 分子量: 293.32IUPAC Name: 3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoic acidSMILES: C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)O)C3=CC=CC=C3InChIKey: OFPXSFXSNFPTHF-UHFFFAOYSA-NInChI: InChI=1S/C18H15NO3/c20-16(21)12-11-15-19-17(13-7-3-1-4-8-13)18(22-15)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,20,21)
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PF-04995274CAS号 : 1331782-27-4 Compound CID : 53354764分子式: C23H32N2O6 分子量: 432.51IUPAC Name: 4-[[4-[[4-[(3R)-oxolan-3-yl]oxy-1,2-benzoxazol-3-yl]oxymethyl]piperidin-1-yl]methyl]oxan-4-olSMILES: C1CN(CCC1COC2=NOC3=C2C(=CC=C3)OC4CCOC4)CC5(CCOCC5)OInChIKey: WLLOFQROROXOMO-GOSISDBHSA-NInChI: InChI=1S/C23H32N2O6/c26-23(7-12-27-13-8-23)16-25-9-4-17(5-10-25)14-29-22-21-19(30-18-6-11-28-15-18)2-1-3-20(21)31-24-22/h1-3,17-18,26H,4-16H2/t18-/m1/s1
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