激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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TC-SP 14,S1P1受体激动剂
- ≥98%(HPLC)
CAS号 : 1257093-40-5 Compound CID : 51346934

分子式: C₂₅H₂₀F₂N₂O₂S 分子量: 450.5

IUPAC Name: 1-[[3-fluoro-4-[5-[(2-fluorophenyl)methyl]-1,3-benzothiazol-2-yl]phenyl]methyl]azetidine-3-carboxylic acid

SMILES: C1C(CN1CC2=CC(=C(C=C2)C3=NC4=C(S3)C=CC(=C4)CC5=CC=CC=C5F)F)C(=O)O

InChIKey: GVXGVDIXINMAAL-UHFFFAOYSA-N

InChI: InChI=1S/C25H20F2N2O2S/c26-20-4-2-1-3-17(20)9-15-6-8-23-22(11-15)28-24(32-23)19-7-5-16(10-21(19)27)12-29-13-18(14-29)25(30)31/h1-8,10-11,18H,9,12-14H2,(H,30,31)
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TC-G 1006,鞘氨醇-1-磷酸受体1（S1P1）激动剂
- ≥98%(HPLC)
CAS号 : 1324003-64-6 Compound CID : 54764919

分子式: C₂₁H₁₆F₃N₃O₃ 分子量: 415.37

IUPAC Name: 4-methoxy-N-[[4-phenyl-3-(trifluoromethyl)phenyl]carbamoyl]pyridine-3-carboxamide

SMILES: COC1=C(C=NC=C1)C(=O)NC(=O)NC2=CC(=C(C=C2)C3=CC=CC=C3)C(F)(F)F

InChIKey: MLDQTQOMWDNTNN-UHFFFAOYSA-N

InChI: InChI=1S/C21H16F3N3O3/c1-30-18-9-10-25-12-16(18)19(28)27-20(29)26-14-7-8-15(13-5-3-2-4-6-13)17(11-14)21(22,23)24/h2-12H,1H3,(H2,26,27,28,29)
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PMX 205（TFA）,C5a受体肽拮抗剂
- ≥98%
CAS号 : 514814-49-4(free base)

分子式: C₄₇H₆₃F₃N₁₀O₈ 分子量: 953.06
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PMX 53,C5a受体拮抗剂
- ≥98%
CAS号 : 219639-75-5(free basis)

分子式: C₄₇H₆₅N₁₁O₇(free basis) 分子量: 896.1(free basis)
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CS 2100,S1P1激动剂
- ≥97%(HPLC)
CAS号 : 913827-99-3 Compound CID : 11977938

分子式: C₂₅H₂₃N₃O₄S 分子量: 461.53

IUPAC Name: 1-[[4-ethyl-5-[5-(4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]thiophen-2-yl]methyl]azetidine-3-carboxylic acid

SMILES: CCC1=C(SC(=C1)CN2CC(C2)C(=O)O)C3=NOC(=N3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChIKey: DWVJASHDNJMDNH-UHFFFAOYSA-N

InChI: InChI=1S/C25H23N3O4S/c1-2-16-12-21(15-28-13-18(14-28)25(29)30)33-22(16)23-26-24(32-27-23)17-8-10-20(11-9-17)31-19-6-4-3-5-7-19/h3-12,18H,2,13-15H2,1H3,(H,29,30)
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Avacopan (CCX168)
- 10mM in DMSO
CAS号 : 1346623-17-3 Compound CID : 49841217

分子式: C₃₃H₃₅F₄N₃O₂ 分子量: 581.64

IUPAC Name: (2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide

SMILES: CC1=C(C(=CC=C1)F)C(=O)N2CCCC(C2C3=CC=C(C=C3)NC4CCCC4)C(=O)NC5=CC(=C(C=C5)C)C(F)(F)F

InChIKey: PUKBOVABABRILL-YZNIXAGQSA-N

InChI: InChI=1S/C33H35F4N3O2/c1-20-12-15-25(19-27(20)33(35,36)37)39-31(41)26-10-6-18-40(32(42)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)38-23-8-3-4-9-23/h5,7,11-17,19,23,26,30,38H,3-4,6,8-10,18H2,1-2H3,(H,39,41)/t26-,30-/m0/s1
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芬戈莫德
- 10mM in DMSO
CAS号 : 162359-55-9 Compound CID : 107970

分子式: C₁₉H₃₃NO₂ 分子量: 307.47

IUPAC Name: 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol

SMILES: CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N

InChIKey: KKGQTZUTZRNORY-UHFFFAOYSA-N

InChI: 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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PMX 53
- 10mM in DMSO
CAS号 : 219639-75-5 Compound CID : 6918468

分子式: C₄₇H₆₅N₁₁O₇ 分子量: 896.1

IUPAC Name: (2S)-2-acetamido-N-[(3S,9S,12S,15R,18S)-15-(cyclohexylmethyl)-9-[3-(diaminomethylideneamino)propyl]-12-(1H-indol-3-ylmethyl)-2,8,11,14,17-pentaoxo-1,7,10,13,16-pentazabicyclo[16.3.0]henicosan-3-yl]-3-phenylpropanamide

SMILES: CC(=O)NC(CC1=CC=CC=C1)C(=O)NC2CCCNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C3CCCN3C2=O)CC4CCCCC4)CC5=CNC6=CC=CC=C65)CCCN=C(N)N

InChIKey: YOKBGCTZYPOSQM-HPSWDUTRSA-N

InChI: InChI=1S/C47H65N11O7/c1-29(59)53-37(25-30-13-4-2-5-14-30)42(61)55-36-20-11-22-50-41(60)35(19-10-23-51-47(48)49)54-44(63)39(27-32-28-52-34-18-9-8-17-33(32)34)56-43(62)38(26-31-15-6-3-7-16-31)57-45(64)40-21-12-24-58(40)46(36)65/h2,4-5,8-9,13-14,17-18,28,31,35-40,52H,3,6-7,10-12,15-16,19-27H2,1H3,(H,50,60)(H,53,59)(H,54,63)(H,55,61)(H,56,62)(H,57,64)(H4,48,49,51)/t35-,36-,37-,38+,39-,40-/m0/s1
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3-Phenyl-5-(4-phenyl-5-(trifluoromethyl)thiophen-2-yl)-1,2,4-oxadiazole
CAS号 : 256414-81-0 Compound CID : 2740144

分子式: C₁₉H₁₁F₃N₂OS 分子量: 372.4

IUPAC Name: 3-phenyl-5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-1,2,4-oxadiazole

SMILES: C1=CC=C(C=C1)C2=C(SC(=C2)C3=NC(=NO3)C4=CC=CC=C4)C(F)(F)F

InChIKey: PJHDZYVIURRTBF-UHFFFAOYSA-N

InChI: InChI=1S/C19H11F3N2OS/c20-19(21,22)16-14(12-7-3-1-4-8-12)11-15(26-16)18-23-17(24-25-18)13-9-5-2-6-10-13/h1-11H

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2-[5-(4-Tert-butylphenyl)-1,3,4-oxadiazol-2-yl]aniline
CAS号 : 159222-57-8 Compound CID : 2799937

分子式: C₁₈H₁₉N₃O 分子量: 293.4

IUPAC Name: 2-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]aniline

SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3N

InChIKey: ORSLEBNPFFMHND-UHFFFAOYSA-N

InChI: InChI=1S/C18H19N3O/c1-18(2,3)13-10-8-12(9-11-13)16-20-21-17(22-16)14-6-4-5-7-15(14)19/h4-11H,19H2,1-3H3

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N-[(4-dimethylaminophenyl)methyl]-7-methoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CAS号 : 405097-49-6 Compound CID : 5311122

分子式: C₃₀H₃₆N₂O₂ 分子量: 456.6

IUPAC Name: N-[[4-(dimethylamino)phenyl]methyl]-7-methoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

SMILES: CC(C)C1=CC=C(C=C1)N(CC2=CC=C(C=C2)N(C)C)C(=O)C3CCCC4=C3C=C(C=C4)OC

InChIKey: DVYASSBBADJRAS-UHFFFAOYSA-N

InChI: InChI=1S/C30H36N2O2/c1-21(2)23-11-16-26(17-12-23)32(20-22-9-14-25(15-10-22)31(3)4)30(33)28-8-6-7-24-13-18-27(34-5)19-29(24)28/h9-19,21,28H,6-8,20H2,1-5H3

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n,n'-1,2-Phenylenebis(n,4-dimethylbenzenesulfonamide)
CAS号 : 29627-62-1 Compound CID : 265219

分子式: C₂₂H₂₄N₂O₄S₂ 分子量: 444.6

IUPAC Name: N,4-dimethyl-N-[2-[methyl-(4-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide

SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2N(C)S(=O)(=O)C3=CC=C(C=C3)C

InChIKey: WOBGBOUAUABUFZ-UHFFFAOYSA-N

InChI: InChI=1S/C22H24N2O4S2/c1-17-9-13-19(14-10-17)29(25,26)23(3)21-7-5-6-8-22(21)24(4)30(27,28)20-15-11-18(2)12-16-20/h5-16H,1-4H3

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