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芬戈莫德CAS号 : 162359-55-9 Compound CID : 107970分子式: C19H33NO2 分子量: 307.47IUPAC Name: 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diolSMILES: CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)NInChIKey: KKGQTZUTZRNORY-UHFFFAOYSA-NInChI: InChI=1S/C19H33NO2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22/h9-12,21-22H,2-8,13-16,20H2,1H3
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来他替尼CAS号 : 111358-88-4 Compound CID : 126565分子式: C26H21N3O4 分子量: 439.46IUPAC Name: (15S,16S,18R)-16-hydroxy-16-(hydroxymethyl)-15-methyl-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaen-3-oneSMILES: CC12C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)(CO)OInChIKey: UIARLYUEJFELEN-LROUJFHJSA-NInChI: InChI=1S/C26H21N3O4/c1-25-26(32,12-30)10-18(33-25)28-16-8-4-2-6-13(16)20-21-15(11-27-24(21)31)19-14-7-3-5-9-17(14)29(25)23(19)22(20)28/h2-9,18,30,32H,10-12H2,1H3,(H,27,31)/t18-,25+,26+/m1/s1
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VerdiperstatCAS号 : 890655-80-8 Compound CID : 11528958分子式: C11H15N3O2S 分子量: 253.32IUPAC Name: 1-(2-propan-2-yloxyethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-oneSMILES: CC(C)OCCN1C2=C(C(=O)NC1=S)NC=C2InChIKey: FVJCUZCRPIMVLB-UHFFFAOYSA-NInChI: InChI=1S/C11H15N3O2S/c1-7(2)16-6-5-14-8-3-4-12-9(8)10(15)13-11(14)17/h3-4,7,12H,5-6H2,1-2H3,(H,13,15,17)
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MPO-IN-28CAS号 : 37836-90-1 Compound CID : 2835211分子式: C11H13N5O 分子量: 231.25IUPAC Name: 2-(7-methoxy-4-methylquinazolin-2-yl)guanidineSMILES: CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OCInChIKey: ZJBMSSBTCGJZEE-UHFFFAOYSA-NInChI: InChI=1S/C11H13N5O/c1-6-8-4-3-7(17-2)5-9(8)15-11(14-6)16-10(12)13/h3-5H,1-2H3,(H4,12,13,14,15,16)
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PF-06282999CAS号 : 1435467-37-0 Compound CID : 71571306分子式: C13H12ClN3O3S 分子量: 325.77IUPAC Name: 2-[6-(5-chloro-2-methoxyphenyl)-4-oxo-2-sulfanylidenepyrimidin-1-yl]acetamideSMILES: COC1=C(C=C(C=C1)Cl)C2=CC(=O)NC(=S)N2CC(=O)NInChIKey: ICYNYWFGIDGBRD-UHFFFAOYSA-NInChI: InChI=1S/C13H12ClN3O3S/c1-20-10-3-2-7(14)4-8(10)9-5-12(19)16-13(21)17(9)6-11(15)18/h2-5H,6H2,1H3,(H2,15,18)(H,16,19,21)
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MPO-IN-28CAS号 : 37836-90-1 Compound CID : 2835211分子式: C11H13N5O 分子量: 231.25IUPAC Name: 2-(7-methoxy-4-methylquinazolin-2-yl)guanidineSMILES: CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OCInChIKey: ZJBMSSBTCGJZEE-UHFFFAOYSA-NInChI: InChI=1S/C11H13N5O/c1-6-8-4-3-7(17-2)5-9(8)15-11(14-6)16-10(12)13/h3-5H,1-2H3,(H4,12,13,14,15,16)
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PF-06282999CAS号 : 1435467-37-0 Compound CID : 71571306分子式: C13H12ClN3O3S 分子量: 325.77IUPAC Name: 2-[6-(5-chloro-2-methoxyphenyl)-4-oxo-2-sulfanylidenepyrimidin-1-yl]acetamideSMILES: COC1=C(C=C(C=C1)Cl)C2=CC(=O)NC(=S)N2CC(=O)NInChIKey: ICYNYWFGIDGBRD-UHFFFAOYSA-NInChI: InChI=1S/C13H12ClN3O3S/c1-20-10-3-2-7(14)4-8(10)9-5-12(19)16-13(21)17(9)6-11(15)18/h2-5H,6H2,1H3,(H2,15,18)(H,16,19,21)
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维迪珀斯塔CAS号 : 890655-80-8 Compound CID : 11528958分子式: C11H15N3O2S 分子量: 253.32IUPAC Name: 1-(2-propan-2-yloxyethyl)-2-sulfanylidene-5H-pyrrolo[3,2-d]pyrimidin-4-oneSMILES: CC(C)OCCN1C2=C(C(=O)NC1=S)NC=C2InChIKey: FVJCUZCRPIMVLB-UHFFFAOYSA-NInChI: InChI=1S/C11H15N3O2S/c1-7(2)16-6-5-14-8-3-4-12-9(8)10(15)13-11(14)17/h3-4,7,12H,5-6H2,1-2H3,(H,13,15,17)
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CCR2 antagonist 3CAS号 : 1380100-86-6(DMSO)分子式: C17H25FN2O2 分子量: 308.39SMILES: CC1=C(C=CC(=C1)C(=O)N(C)C(CN2CC(C2)O)C(C)C)F
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CCR2 antagonist 3CAS号 : 1380100-86-6 Compound CID : 57345449分子式: C17H25FN2O2 分子量: 308.39IUPAC Name: 4-fluoro-N-[(2S)-1-(3-hydroxyazetidin-1-yl)-3-methylbutan-2-yl]-N,3-dimethylbenzamideSMILES: CC1=C(C=CC(=C1)C(=O)N(C)C(CN2CC(C2)O)C(C)C)FInChIKey: GAHPWXLXWUVMIV-MRXNPFEDSA-NInChI: InChI=1S/C17H25FN2O2/c1-11(2)16(10-20-8-14(21)9-20)19(4)17(22)13-5-6-15(18)12(3)7-13/h5-7,11,14,16,21H,8-10H2,1-4H3/t16-/m1/s1
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