配体家族 - 小分子和化合物库

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TC JL 37,TYK2抑制剂
- ≥98%(HPLC)
CAS号: 1258294-34-6 Compound CID : 56934550

分子式: C₁₇H₁₁ClF₂N₄O₂ 分子量: 376.74

IUPAC Name: 2-chloro-4-cyano-6-fluoro-N-[2-[[(1R,2R)-2-fluorocyclopropanecarbonyl]amino]pyridin-4-yl]benzamide

SMILES: C1C(C1F)C(=O)NC2=NC=CC(=C2)NC(=O)C3=C(C=C(C=C3Cl)C#N)F

InChIKey: NKALKXMQBFLGQI-CMPLNLGQSA-N

InChI: 1S/C17H11ClF2N4O2/c18-11-3-8(7-21)4-13(20)15(11)17(26)23-9-1-2-22-14(5-9)24-16(25)10-6-12(10)19/h1-5,10,12H,6H2,(H2,22,23,24,25,26)/t10-,12+/m0/s1
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TC-A 2317 盐酸盐
- ≥98%(HPLC)
CAS号: 1245907-03-2 Compound CID : 46911725

分子式: C₁₉H₂₈N₆O.HCl 分子量: 392.93

IUPAC Name: 2-[(6-hydroxy-6-methylheptan-2-yl)amino]-4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridine-3-carbonitrile;hydrochloride

SMILES: CC1=CC(=NC(=C1C#N)NC(C)CCCC(C)(C)O)NC2=NNC(=C2)C.Cl

InChIKey: DXVATYHPJJPMIN-UHFFFAOYSA-N

InChI: 1S/C19H28N6O.ClH/c1-12-9-16(22-17-10-14(3)24-25-17)23-18(15(12)11-20)21-13(2)7-6-8-19(4,5)26;/h9-10,13,26H,6-8H2,1-5H3,(H3,21,22,23,24,25);1H
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AZ 13705339,PAK1和PAK2抑制剂
- ≥98%(HPLC)
CAS号: 2016806-57-6

分子式: C₃₃H₃₆FN₇O₃S 分子量: 629.75

IUPAC Name: 2-[[N-[2-[3-ethylsulfonyl-4-(4-methylpiperazin-1-yl)anilino]-5-fluoropyrimidin-4-yl]-5-(hydroxymethyl)-2-methylanilino]methyl]benzonitrile

SMILES: CCS(=O)(=O)C1=C(C=CC(=C1)NC2=NC=C(C(=N2)N(CC3=CC=CC=C3C#N)C4=C(C=CC(=C4)CO)C)F)N5CCN(CC5)C

InChIKey: WPFLVPJXKWCRQK-UHFFFAOYSA-N

InChI: 1S/C33H36FN7O3S/c1-4-45(43,44)31-18-27(11-12-29(31)40-15-13-39(3)14-16-40)37-33-36-20-28(34)32(38-33)41(21-26-8-6-5-7-25(26)19-35)30-17-24(22-42)10-9-23(30)2/h5-12,17-18,20,42H,4,13-16,21-22H2,1-3H3,(See more
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Ibrutinib (PCI-32765)
- 10mM in DMSO
CAS号: 936563-96-1

分子式: C₂₅H₂₄N₆O₂ 分子量: 440.5
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SJ988497
IUPAC Name: N-[4-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]butyl]-4-[[4-(1-propylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amino]benzamide

SMILES: CCCn1cc(cn1)c1c2cc[nH]c2nc(n1)Nc1ccc(cc1)C(=O)NCCCCNc1cccc2c1C(=O)N(C2=O)C1CCC(=O)NC1=O

InChIKey: MPFPDTOOHBZQJD-UHFFFAOYSA-N

InChI: 1S/C36H36N10O5/c1-2-18-45-20-22(19-40-45)30-25-14-17-38-31(25)44-36(43-30)41-23-10-8-21(9-11-23)32(48)39-16-4-3-15-37-26-7-5-6-24-29(26)35(51)46(34(24)50)27-12-13-28(47)42-33(27)49/h5-11,14,17,19-20,2See more
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AZ-23
- 10mM in DMSO
CAS号: 915720-21-7 Compound CID : 16097523

分子式: C₁₇H₁₉ClFN₇O 分子量: 391.83
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AZ-23
- ≥98%
CAS号: 915720-21-7 Compound CID : 16097523

分子式: C₁₇H₁₉ClFN₇O 分子量: 391.83

IUPAC Name: 5-chloro-2-N-[(1S)-1-(5-fluoropyridin-2-yl)ethyl]-4-N-(3-propan-2-yloxy-1H-pyrazol-5-yl)pyrimidine-2,4-diamine

SMILES: CC(C)OC1=NNC(=C1)NC2=NC(=NC=C2Cl)NC(C)C3=NC=C(C=C3)F

InChIKey: LBVKEEFIPBQIMD-JTQLQIEISA-N

InChI: 1S/C17H19ClFN7O/c1-9(2)27-15-6-14(25-26-15)23-16-12(18)8-21-17(24-16)22-10(3)13-5-4-11(19)7-20-13/h4-10H,1-3H3,(H3,21,22,23,24,25,26)/t10-/m0/s1
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PF03394197
- ≥98%
CAS号: 1208319-26-9 EC号: 950-980-7 Compound CID : 44631938

分子式: C₁₅H₂₃N₅O₂S 分子量: 337.44

IUPAC Name: N-methyl-1-[4-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]cyclohexyl]methanesulfonamide

SMILES: CNS(=O)(=O)CC1CCC(CC1)N(C)C2=NC=NC3=C2C=CN3

InChIKey: HJWLJNBZVZDLAQ-UHFFFAOYSA-N

InChI: 1S/C15H23N5O2S/c1-16-23(21,22)9-11-3-5-12(6-4-11)20(2)15-13-7-8-17-14(13)18-10-19-15/h7-8,10-12,16H,3-6,9H2,1-2H3,(H,17,18,19)
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