免疫配体 - 小分子和化合物库

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瑞帕利辛
- ≥98%
CAS号 : 266359-83-5 Compound CID : 9838712

分子式: C₁₄H₂₁NO₃S 分子量: 283.39

IUPAC Name: (2R)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfonylpropanamide

SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)NS(=O)(=O)C

InChIKey: KQDRVXQXKZXMHP-LLVKDONJSA-N

InChI: InChI=1S/C14H21NO3S/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-19(4,17)18/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
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RS504393,CCR2趋化因子受体拮抗剂
- ≥98%(HPLC)
CAS号 : 300816-15-3 Compound CID : 9953769

分子式: C₂₅H₂₇N₃O₃ 分子量: 417.5

IUPAC Name: 6-methyl-1'-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethyl]spiro[1H-3,1-benzoxazine-4,4'-piperidine]-2-one

SMILES: CC1=CC2=C(C=C1)NC(=O)OC23CCN(CC3)CCC4=C(OC(=N4)C5=CC=CC=C5)C

InChIKey: ODNICNWASXKNNQ-UHFFFAOYSA-N

InChI: InChI=1S/C25H27N3O3/c1-17-8-9-22-20(16-17)25(31-24(29)27-22)11-14-28(15-12-25)13-10-21-18(2)30-23(26-21)19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3,(H,27,29)
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西尼昔洛韦
- ≥97%
CAS号 : 497223-25-3 Compound CID : 11285792

分子式: C₄₁H₅₂N₄O₄S 分子量: 696.95

IUPAC Name: (5E)-8-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-N-[4-[(S)-(3-propylimidazol-4-yl)methylsulfinyl]phenyl]-3,4-dihydro-2H-1-benzazocine-5-carboxamide

SMILES: CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCCC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)CC5=CN=CN5CCC)CC(C)C

InChIKey: PNDKCRDVVKJPKG-WHERJAGFSA-N

InChI: InChI=1S/C41H52N4O4S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-27-42-30-45(37)20-6-2/h10-19,25-27,30-31H,5-9,20-24,28-29H2,1-4H3,(H,43,46)/b34-26+/t50-/m0/s1
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达尼利星
- ≥97%
CAS号 : 954126-98-8 Compound CID : 24780598

分子式: C₁₉H₂₂Cl₂FN₃O₄S 分子量: 441.90

IUPAC Name: 1-[4-chloro-2-hydroxy-3-[(3S)-piperidin-3-yl]sulfonylphenyl]-3-(3-fluoro-2-methylphenyl)urea

SMILES: CC1=C(C=CC=C1F)NC(=O)NC2=C(C(=C(C=C2)Cl)S(=O)(=O)C3CCCNC3)O

InChIKey: NGYNBSHYFOFVLS-LBPRGKRZSA-N

InChI: InChI=1S/C19H21ClFN3O4S/c1-11-14(21)5-2-6-15(11)23-19(26)24-16-8-7-13(20)18(17(16)25)29(27,28)12-4-3-9-22-10-12/h2,5-8,12,22,25H,3-4,9-10H2,1H3,(H2,23,24,26)/t12-/m0/s1
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SB 225002,非肽CXCR2拮抗剂
- ≥98%
CAS号 : 182498-32-4 Compound CID : 3854666

分子式: C₁₃H₁₀BrN₃O₄ 分子量: 352.14

IUPAC Name: 1-(2-bromophenyl)-3-(2-hydroxy-4-nitrophenyl)urea

SMILES: C1=CC=C(C(=C1)NC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)Br

InChIKey: MQBZVUNNWUIPMK-UHFFFAOYSA-N

InChI: InChI=1S/C13H10BrN3O4/c14-9-3-1-2-4-10(9)15-13(19)16-11-6-5-8(17(20)21)7-12(11)18/h1-7,18H,(H2,15,16,19)
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RS 102895
- ≥98%
CAS号 : 300815-41-2 Compound CID : 16759153

分子式: C₂₁H₂₁F₃N₂O₂ 分子量: 390.40

IUPAC Name: 1'-[2-[4-(trifluoromethyl)phenyl]ethyl]spiro[1H-3,1-benzoxazine-4,4'-piperidine]-2-one;hydrochloride

SMILES: C1CN(CCC12C3=CC=CC=C3NC(=O)O2)CCC4=CC=C(C=C4)C(F)(F)F.Cl

InChIKey: KRRISOFSWVKYBF-UHFFFAOYSA-N

InChI: InChI=1S/C21H21F3N2O2.ClH/c22-21(23,24)16-7-5-15(6-8-16)9-12-26-13-10-20(11-14-26)17-3-1-2-4-18(17)25-19(27)28-20;/h1-8H,9-14H2,(H,25,27);1H
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AZD5069
- ≥98%
CAS号 : 878385-84-3 Compound CID : 56645576

分子式: C₁₈H₂₂F₂N₄O₅S₂ 分子量: 476.52

IUPAC Name: N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[(2R,3S)-3,4-dihydroxybutan-2-yl]oxypyrimidin-4-yl]azetidine-1-sulfonamide

SMILES: CC(C(CO)O)OC1=NC(=NC(=C1)NS(=O)(=O)N2CCC2)SCC3=C(C(=CC=C3)F)F

InChIKey: QZECRCLSIGFCIO-RISCZKNCSA-N

InChI: InChI=1S/C18H22F2N4O5S2/c1-11(14(26)9-25)29-16-8-15(23-31(27,28)24-6-3-7-24)21-18(22-16)30-10-12-4-2-5-13(19)17(12)20/h2,4-5,8,11,14,25-26H,3,6-7,9-10H2,1H3,(H,21,22,23)/t11-,14+/m1/s1
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Navarixin (SCH-527123)
- ≥98%
CAS号 : 473727-83-2 Compound CID : 9865554

分子式: C₂₁H₂₃N₃O₅ 分子量: 397.42

IUPAC Name: 2-hydroxy-N,N-dimethyl-3-[[2-[[(1R)-1-(5-methylfuran-2-yl)propyl]amino]-3,4-dioxocyclobuten-1-yl]amino]benzamide

SMILES: CCC(C1=CC=C(O1)C)NC2=C(C(=O)C2=O)NC3=CC=CC(=C3O)C(=O)N(C)C

InChIKey: RXIUEIPPLAFSDF-CYBMUJFWSA-N

InChI: InChI=1S/C21H23N3O5/c1-5-13(15-10-9-11(2)29-15)22-16-17(20(27)19(16)26)23-14-8-6-7-12(18(14)25)21(28)24(3)4/h6-10,13,22-23,25H,5H2,1-4H3/t13-/m1/s1
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纳瓦里新(SCH-527123)
- 10mM in DMSO
CAS号 : 473727-83-2 Compound CID : 9865554

分子式: C₂₁H₂₃N₃O₅ 分子量: 397.42

IUPAC Name: 2-hydroxy-N,N-dimethyl-3-[[2-[[(1R)-1-(5-methylfuran-2-yl)propyl]amino]-3,4-dioxocyclobuten-1-yl]amino]benzamide

SMILES: CCC(C1=CC=C(O1)C)NC2=C(C(=O)C2=O)NC3=CC=CC(=C3O)C(=O)N(C)C

InChIKey: RXIUEIPPLAFSDF-CYBMUJFWSA-N

InChI: InChI=1S/C21H23N3O5/c1-5-13(15-10-9-11(2)29-15)22-16-17(20(27)19(16)26)23-14-8-6-7-12(18(14)25)21(28)24(3)4/h6-10,13,22-23,25H,5H2,1-4H3/t13-/m1/s1
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普乐沙福
- 2mM in Water
CAS号 : 110078-46-1 Compound CID : 65015

分子式: C₂₈H₅₄N₈ 分子量: 502.78

IUPAC Name: 1-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1,4,8,11-tetrazacyclotetradecane

SMILES: C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CN3CCCNCCNCCCNCC3

InChIKey: YIQPUIGJQJDJOS-UHFFFAOYSA-N

InChI: InChI=1S/C28H54N8/c1-9-29-15-17-31-13-3-21-35(23-19-33-11-1)25-27-5-7-28(8-6-27)26-36-22-4-14-32-18-16-30-10-2-12-34-20-24-36/h5-8,29-34H,1-4,9-26H2
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Reparixin
- 10mM in DMSO
CAS号 : 266359-83-5 Compound CID : 9838712

分子式: C₁₄H₂₁NO₃S 分子量: 283.39

IUPAC Name: (2R)-2-[4-(2-methylpropyl)phenyl]-N-methylsulfonylpropanamide

SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)NS(=O)(=O)C

InChIKey: KQDRVXQXKZXMHP-LLVKDONJSA-N

InChI: InChI=1S/C14H21NO3S/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-19(4,17)18/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
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RS 102895盐酸盐
- 10mM in DMSO
CAS号 : 300815-41-2 Compound CID : 16759153

分子式: C₂₁H₂₁F₃N₂O₂ 分子量: 390.40

IUPAC Name: 1'-[2-[4-(trifluoromethyl)phenyl]ethyl]spiro[1H-3,1-benzoxazine-4,4'-piperidine]-2-one;hydrochloride

SMILES: C1CN(CCC12C3=CC=CC=C3NC(=O)O2)CCC4=CC=C(C=C4)C(F)(F)F.Cl

InChIKey: KRRISOFSWVKYBF-UHFFFAOYSA-N

InChI: InChI=1S/C21H21F3N2O2.ClH/c22-21(23,24)16-7-5-15(6-8-16)9-12-26-13-10-20(11-14-26)17-3-1-2-4-18(17)25-19(27)28-20;/h1-8H,9-14H2,(H,25,27);1H
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