小分子和化合物库
选项
-
INCB024360 类似物CAS号 : 914471-09-3 Compound CID : 135424953分子式: C9H7ClFN5O2 分子量: 271.64IUPAC Name: 4-amino-N'-(3-chloro-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamideSMILES: C1=CC(=C(C=C1N=C(C2=NON=C2N)NO)Cl)FInChIKey: HGXSLPIXNPASGZ-UHFFFAOYSA-NInChI: InChI=1S/C9H7ClFN5O2/c10-5-3-4(1-2-6(5)11)13-9(14-17)7-8(12)16-18-15-7/h1-3,17H,(H2,12,16)(H,13,14)
-
IDO-IN-1CAS号 : 914638-30-5 Compound CID : 135741412分子式: C9H7BrFN5O2 分子量: 316.087IUPAC Name: 4-amino-N'-(3-bromo-4-fluorophenyl)-N-hydroxy-1,2,5-oxadiazole-3-carboximidamideSMILES: C1=CC(=C(C=C1N=C(C2=NON=C2N)NO)Br)FInChIKey: ORHZJUSHZUCMKR-UHFFFAOYSA-NInChI: InChI=1S/C9H7BrFN5O2/c10-5-3-4(1-2-6(5)11)13-9(14-17)7-8(12)16-18-15-7/h1-3,17H,(H2,12,16)(H,13,14)
-
Necrostatin-1,N-去甲基硫代乙内酰脲类似物CAS号 : 64419-92-7 Compound CID : 5371761分子式: C12H11N3OS 分子量: 245.3IUPAC Name: 5-(1H-indol-3-ylmethyl)-2-sulfanylideneimidazolidin-4-oneSMILES: C1=CC=C2C(=C1)C(=CN2)CC3C(=O)NC(=S)N3InChIKey: MPLRRPKKFHUEEL-UHFFFAOYSA-NInChI: InChI=1S/C12H11N3OS/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6,10,13H,5H2,(H2,14,15,16,17)
-
TC-G 1004CAS号 : 1061747-72-5 Compound CID : 25074316分子式: C22H27N7O2 分子量: 421.5IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)-6-[6-(4-methoxypiperidin-1-yl)pyridin-2-yl]pyrimidin-4-yl]acetamideSMILES: CC1=CC(=NN1C2=NC(=CC(=N2)NC(=O)C)C3=NC(=CC=C3)N4CCC(CC4)OC)CInChIKey: JENSDTKXNVHSSN-UHFFFAOYSA-NInChI: InChI=1S/C22H27N7O2/c1-14-12-15(2)29(27-14)22-25-19(13-20(26-22)23-16(3)30)18-6-5-7-21(24-18)28-10-8-17(31-4)9-11-28/h5-7,12-13,17H,8-11H2,1-4H3,(H,23,25,26,30)
-
LUF 5834,腺苷A2A和A2B受体部分激动剂CAS号 : 333962-91-7 Compound CID : 135543624分子式: C17H12N6OS 分子量: 348.38IUPAC Name: 2-amino-4-(4-hydroxyphenyl)-6-(1H-imidazol-2-ylmethylsulfanyl)pyridine-3,5-dicarbonitrileSMILES: C1=CC(=CC=C1C2=C(C(=NC(=C2C#N)SCC3=NC=CN3)N)C#N)OInChIKey: OFHKDLYFKPBXER-UHFFFAOYSA-NInChI: InChI=1S/C17H12N6OS/c18-7-12-15(10-1-3-11(24)4-2-10)13(8-19)17(23-16(12)20)25-9-14-21-5-6-22-14/h1-6,24H,9H2,(H2,20,23)(H,21,22)
-
7-氯-4-羟基-2-苯基-1,8-萘啶CAS号 : 286411-09-4 Compound CID : 6105572分子式: C14H9N2OCl 分子量: 256.69IUPAC Name: 7-chloro-2-phenyl-1H-1,8-naphthyridin-4-oneSMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(N2)N=C(C=C3)ClInChIKey: JSCUNIPKMPNPFX-UHFFFAOYSA-NInChI: InChI=1S/C14H9ClN2O/c15-13-7-6-10-12(18)8-11(16-14(10)17-13)9-4-2-1-3-5-9/h1-8H,(H,16,17,18)
-
CAY10680CAS号 : 1439488-21-7 Compound CID : 71680733分子式: C18H16N2O2S 分子量: 324.40IUPAC Name: N-(4-oxo-3,1-benzothiazin-2-yl)-4-phenylbutanamideSMILES: C1=CC=C(C=C1)CCCC(=O)NC2=NC3=CC=CC=C3C(=O)S2InChIKey: QMBOZLGNPMVERZ-UHFFFAOYSA-NInChI: InChI=1S/C18H16N2O2S/c21-16(12-6-9-13-7-2-1-3-8-13)20-18-19-15-11-5-4-10-14(15)17(22)23-18/h1-5,7-8,10-11H,6,9,12H2,(H,19,20,21)
-
-
5'-氨基-5'- 脱氧腺苷CAS号 : 14365-44-7 Compound CID : 9816781分子式: C10H14N6O3 分子量: 266.26IUPAC Name: (2R,3S,4R,5R)-2-(aminomethyl)-5-(6-aminopurin-9-yl)oxolane-3,4-diolSMILES: C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CN)O)O)NInChIKey: GVSGUDGNTHCZHI-KQYNXXCUSA-NInChI: InChI=1S/C10H14N6O3/c11-1-4-6(17)7(18)10(19-4)16-3-15-5-8(12)13-2-14-9(5)16/h2-4,6-7,10,17-18H,1,11H2,(H2,12,13,14)/t4-,6-,7-,10-/m1/s1
-
Epacadostat (INCB024360)CAS号 : 1204669-58-8(DMSO)分子式: C11H13BrFN7O4S 分子量: 438.23SMILES: N[S](=O)(=O)NCCNC1=NON=C1C(NO)=NC2=CC(=C(F)C=C2)Br
-
Linrodostat (BMS-986205)CAS号 : 1923833-60-6(DMSO)分子式: C24H24ClFN2O 分子量: 410.91SMILES: CC(C1CCC(CC1)C2=CC=NC3=C2C=C(F)C=C3)C(=O)NC4=CC=C(Cl)C=C4
-
Necrostatin-1CAS号 : 4311-88-0(DMSO)分子式: C13H13N3OS 分子量: 259.33SMILES: CN1C(=O)C(CC2=C[NH]C3=CC=CC=C23)NC1=S
首页
400-620-6333











