配体家族 - 小分子和化合物库

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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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Piclamilast,PDE4抑制剂
- ≥99%(HPLC)
CAS号: 144035-83-6 Compound CID : 154575

分子式: C₁₈H₁₈Cl₂N₂O₃ 分子量: 381.25

IUPAC Name: 3-cyclopentyloxy-N-(3,5-dichloropyridin-4-yl)-4-methoxybenzamide

SMILES: COC1=C(C=C(C=C1)C(=O)NC2=C(C=NC=C2Cl)Cl)OC3CCCC3

InChIKey: RRRUXBQSQLKHEL-UHFFFAOYSA-N

InChI: 1S/C18H18Cl2N2O3/c1-24-15-7-6-11(8-16(15)25-12-4-2-3-5-12)18(23)22-17-13(19)9-21-10-14(17)20/h6-10,12H,2-5H2,1H3,(H,21,22,23)
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PD 180970,p210Bcr / Ablkinase抑制剂
- ≥98%(HPLC)
CAS号: 287204-45-9 Compound CID : 5311104

分子式: C₂₁H₁₅Cl₂FN₄O 分子量: 429.27

IUPAC Name: 6-(2,6-dichlorophenyl)-2-(4-fluoro-3-methylanilino)-8-methylpyrido[2,3-d]pyrimidin-7-one

SMILES: CC1=C(C=CC(=C1)NC2=NC=C3C=C(C(=O)N(C3=N2)C)C4=C(C=CC=C4Cl)Cl)F

InChIKey: SLCFEJAMCRLYRG-UHFFFAOYSA-N

InChI: 1S/C21H15Cl2FN4O/c1-11-8-13(6-7-17(11)24)26-21-25-10-12-9-14(20(29)28(2)19(12)27-21)18-15(22)4-3-5-16(18)23/h3-10H,1-2H3,(H,25,26,27)
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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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LEO 39652
- 10mM in DMSO
CAS号: 1445656-91-6 Compound CID : 71611998

分子式: C₂₃H₂₃N₃O₅ 分子量: 421.45
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SM1-71
- 10mM in DMSO
CAS号: 2088179-99-9 Compound CID : 131801160

分子式: C₂₄H₂₆ClN₇O 分子量: 463.96
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ITI-214
- 10mM in DMSO
CAS号: 1642303-38-5 Compound CID : 72704434

分子式: C₂₉H₂₉FN₇O₅P 分子量: 605.6
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SM1-71
- ≥96%
CAS号: 2088179-99-9 Compound CID : 131801160

分子式: C₂₄H₂₆ClN₇O 分子量: 463.96

IUPAC Name: N-[2-[[5-chloro-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide

SMILES: CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4NC(=O)C=C)Cl

InChIKey: SCMLGVPMSXTUNC-UHFFFAOYSA-N

InChI: 1S/C24H26ClN7O/c1-3-22(33)28-20-6-4-5-7-21(20)29-23-19(25)16-26-24(30-23)27-17-8-10-18(11-9-17)32-14-12-31(2)13-15-32/h3-11,16H,1,12-15H2,2H3,(H,28,33)(H2,26,27,29,30)
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LEO 39652
- ≥99%
CAS号: 1445656-91-6 Compound CID : 71611998

分子式: C₂₃H₂₃N₃O₅ 分子量: 421.45

IUPAC Name: 2-methylpropyl 1-[8-methoxy-5-(1-oxo-3H-2-benzofuran-5-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropane-1-carboxylate

SMILES: CC(C)COC(=O)C1(CC1)C2=NN3C(=CC=C(C3=N2)OC)C4=CC5=C(C=C4)C(=O)OC5

InChIKey: LUUUHUYQTLUIDG-UHFFFAOYSA-N

InChI: 1S/C23H23N3O5/c1-13(2)11-31-22(28)23(8-9-23)21-24-19-18(29-3)7-6-17(26(19)25-21)14-4-5-16-15(10-14)12-30-20(16)27/h4-7,10,13H,8-9,11-12H2,1-3H3
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ITI-214
- ≥99%
CAS号: 1642303-38-5 Compound CID : 72704434

分子式: C₂₉H₂₉FN₇O₅P 分子量: 605.6

IUPAC Name: (11R,15S)-5-anilino-4-[[4-(6-fluoropyridin-2-yl)phenyl]methyl]-8-methyl-1,3,4,8,10-pentazatetracyclo[7.6.0.02,6.011,15]pentadeca-2,5,9-trien-7-one;phosphoric acid

SMILES: CN1C(=O)C2=C(N(N=C2N3C1=NC4C3CCC4)CC5=CC=C(C=C5)C6=NC(=CC=C6)F)NC7=CC=CC=C7.OP(=O)(O)O

InChIKey: ZPIAAFIYOPWWJL-RFPXDPOKSA-N

InChI: 1S/C29H26FN7O.H3O4P/c1-35-28(38)25-26(31-20-7-3-2-4-8-20)36(34-27(25)37-23-11-5-10-22(23)33-29(35)37)17-18-13-15-19(16-14-18)21-9-6-12-24(30)32-21;1-5(2,3)4/h2-4,6-9,12-16,22-23,31H,5,10-11,17H2,1H3;(See more
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