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法舒地尔CAS号: 103745-39-7分子式: C14H17N3O2S 分子量: 291.37IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinolineSMILES: C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3InChIKey: NGOGFTYYXHNFQH-UHFFFAOYSA-NInChI: 1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2
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Piclamilast,PDE4抑制剂CAS号: 144035-83-6 Compound CID : 154575分子式: C18H18Cl2N2O3 分子量: 381.25IUPAC Name: 3-cyclopentyloxy-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamideSMILES: COC1=C(C=C(C=C1)C(=O)NC2=C(C=NC=C2Cl)Cl)OC3CCCC3InChIKey: RRRUXBQSQLKHEL-UHFFFAOYSA-NInChI: 1S/C18H18Cl2N2O3/c1-24-15-7-6-11(8-16(15)25-12-4-2-3-5-12)18(23)22-17-13(19)9-21-10-14(17)20/h6-10,12H,2-5H2,1H3,(H,21,22,23)
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Mesopram,PDE4抑制剂CAS号: 189940-24-7分子式: C14H19NO4 分子量: 265.31IUPAC Name: (5R)-5-(4-methoxy-3-propoxyphenyl)-5-methyl-1,3-oxazolidin-2-oneSMILES: CCCOC1=C(C=CC(=C1)C2(CNC(=O)O2)C)OCInChIKey: PCCPERGCFKIYIS-AWEZNQCLSA-NInChI: 1S/C14H19NO4/c1-4-7-18-12-8-10(5-6-11(12)17-3)14(2)9-15-13(16)19-14/h5-6,8H,4,7,9H2,1-3H3,(H,15,16)/t14-/m0/s1
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GSK 269962,ROCK抑制剂CAS号: 850664-21-0分子式: C29H30N8O5 分子量: 570.6IUPAC Name: N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamideSMILES: CCN1C2=CC(=NC=C2N=C1C3=NON=C3N)OC4=CC=CC(=C4)NC(=O)C5=CC=C(C=C5)OCCN6CCOCC6InChIKey: YOVNFNXUCOWYSG-UHFFFAOYSA-NInChI: 1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
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A 33,PDE4B抑制剂CAS号: 915082-52-9分子式: C19H18ClN3O2S 分子量: 387.88IUPAC Name: 2-[4-[[2-(5-chlorothiophen-2-yl)-5-ethyl-6-methylpyrimidin-4-yl]amino]phenyl]acetic acidSMILES: CCC1=C(N=C(N=C1NC2=CC=C(C=C2)CC(=O)O)C3=CC=C(S3)Cl)CInChIKey: FDVSPBLZPJMXFV-UHFFFAOYSA-NInChI: 1S/C19H18ClN3O2S/c1-3-14-11(2)21-19(15-8-9-16(20)26-15)23-18(14)22-13-6-4-12(5-7-13)10-17(24)25/h4-9H,3,10H2,1-2H3,(H,24,25)(H,21,22,23)
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GSK 269962CAS号: 850664-21-0分子式: C29H30N8O5 分子量: 570.6IUPAC Name: N-[3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethylimidazo[4,5-c]pyridin-6-yl]oxyphenyl]-4-(2-morpholin-4-ylethoxy)benzamideSMILES: CCN1C2=CC(=NC=C2N=C1C3=NON=C3N)OC4=CC=CC(=C4)NC(=O)C5=CC=C(C=C5)OCCN6CCOCC6InChIKey: YOVNFNXUCOWYSG-UHFFFAOYSA-NInChI: 1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
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ROCK inhibitor-2CAS号: 1127308-52-4 Compound CID : 51003130分子式: C21H20N2O2 分子量: 332.40IUPAC Name: N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-pyridin-4-ylbenzamideSMILES: CC(C1=CC(=CC=C1)OC)NC(=O)C2=CC=C(C=C2)C3=CC=NC=C3InChIKey: JRVSFZKYQCETAH-OAHLLOKOSA-NInChI: 1S/C21H20N2O2/c1-15(19-4-3-5-20(14-19)25-2)23-21(24)18-8-6-16(7-9-18)17-10-12-22-13-11-17/h3-15H,1-2H3,(H,23,24)/t15-/m1/s1
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RKI-1313CAS号: 1342276-76-9 Compound CID : 53492330分子式: C17H16N4O2S 分子量: 340.40IUPAC Name: 1-[(3-methoxyphenyl)methyl]-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)ureaSMILES: COC1=CC=CC(=C1)CNC(=O)NC2=NC(=CS2)C3=CC=NC=C3InChIKey: BDCUKYUIVYKXCQ-UHFFFAOYSA-NInChI: 1S/C17H16N4O2S/c1-23-14-4-2-3-12(9-14)10-19-16(22)21-17-20-15(11-24-17)13-5-7-18-8-6-13/h2-9,11H,10H2,1H3,(H2,19,20,21,22)
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