小分子和化合物库
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LY2886721,BACE-1抑制剂CAS号 : 1262036-50-9 Compound CID : 49837968分子式: C18H16F2N4O2S 分子量: 390.41IUPAC Name: N-[3-[(4aS,7aS)-2-amino-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]thiazin-7a-yl]-4-fluorophenyl]-5-fluoropyridine-2-carboxamideSMILES: C1C2CSC(=NC2(CO1)C3=C(C=CC(=C3)NC(=O)C4=NC=C(C=C4)F)F)NInChIKey: NIDRNVHMMDAAIK-YPMLDQLKSA-NInChI: InChI=1S/C18H16F2N4O2S/c19-11-1-4-15(22-6-11)16(25)23-12-2-3-14(20)13(5-12)18-9-26-7-10(18)8-27-17(21)24-18/h1-6,10H,7-9H2,(H2,21,24)(H,23,25)/t10-,18-/m0/s1
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LY2811376,β-分泌酶抑制剂CAS号 : 1194044-20-6 Compound CID : 44251605分子式: C15H14F2N4S 分子量: 320.36IUPAC Name: (4S)-4-(2,4-difluoro-5-pyrimidin-5-ylphenyl)-4-methyl-5,6-dihydro-1,3-thiazin-2-amineSMILES: CC1(CCSC(=N1)N)C2=C(C=C(C(=C2)C3=CN=CN=C3)F)FInChIKey: MJQMRGWYPNIERM-HNNXBMFYSA-NInChI: InChI=1S/C15H14F2N4S/c1-15(2-3-22-14(18)21-15)11-4-10(12(16)5-13(11)17)9-6-19-8-20-7-9/h4-8H,2-3H2,1H3,(H2,18,21)/t15-/m0/s1
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L-精氨酸分子式: C6H14N4O2 分子量: 174.20 g/molIUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acidSMILES: C(CC(C(=O)O)N)CN=C(N)NInChIKey: ODKSFYDXXFIFQN-BYPYZUCNSA-NInChI: InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1
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UmibecestatCAS号 : 1387560-01-1 Compound CID : 88602735分子式: C19H15ClF7N5O2 分子量: 513.80IUPAC Name: N-[6-[(3R,6R)-5-amino-3,6-dimethyl-6-(trifluoromethyl)-2H-1,4-oxazin-3-yl]-5-fluoropyridin-2-yl]-3-chloro-5-(trifluoromethyl)pyridine-2-carboxamideSMILES: CC1(COC(C(=N1)N)(C)C(F)(F)F)C2=C(C=CC(=N2)NC(=O)C3=C(C=C(C=N3)C(F)(F)F)Cl)FInChIKey: PSBBWFNMHDUTRH-DLBZAZTESA-NInChI: InChI=1S/C19H15ClF7N5O2/c1-16(7-34-17(2,15(28)32-16)19(25,26)27)13-10(21)3-4-11(30-13)31-14(33)12-9(20)5-8(6-29-12)18(22,23)24/h3-6H,7H2,1-2H3,(H2,28,32)(H,30,31,33)/t16-,17+/m0/s1
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