激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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G-749
- 10mM in DMSO
CAS号 : 1457983-28-6 Compound CID : 78357765

分子式: C₂₅H₂₅BrN₆O₂ 分子量: 521.41

IUPAC Name: 8-bromo-2-[(1-methylpiperidin-4-yl)amino]-4-(4-phenoxyanilino)-6H-pyrido[4,3-d]pyrimidin-5-one

SMILES: CN1CCC(CC1)NC2=NC3=C(C(=O)NC=C3Br)C(=N2)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChIKey: SXWMIXPJPNCXQQ-UHFFFAOYSA-N

InChI: InChI=1S/C25H25BrN6O2/c1-32-13-11-17(12-14-32)29-25-30-22-20(26)15-27-24(33)21(22)23(31-25)28-16-7-9-19(10-8-16)34-18-5-3-2-4-6-18/h2-10,15,17H,11-14H2,1H3,(H,27,33)(H2,28,29,30,31)
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G1T38
- 2mM in DMSO
CAS号 : 1628256-23-4 Compound CID : 86269224

分子式: C₂₆H₃₄N₈O 分子量: 474.6

IUPAC Name: 4-[[5-(4-propan-2-ylpiperazin-1-yl)pyridin-2-yl]amino]spiro[1,3,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraene-13,1'-cyclohexane]-10-one

SMILES: CC(C)N1CCN(CC1)C2=CN=C(C=C2)NC3=NC=C4C=C5C(=O)NCC6(N5C4=N3)CCCCC6

InChIKey: YPJRHEKCFKOVRT-UHFFFAOYSA-N

InChI: InChI=1S/C26H34N8O/c1-18(2)32-10-12-33(13-11-32)20-6-7-22(27-16-20)30-25-28-15-19-14-21-24(35)29-17-26(8-4-3-5-9-26)34(21)23(19)31-25/h6-7,14-16,18H,3-5,8-13,17H2,1-2H3,(H,29,35)(H,27,28,30,31)
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SKLB4771 (FLT3-IN-1)
- 10mM in DMSO
CAS号 : 1370256-78-2 Compound CID : 57412684

分子式: C₂₅H₂₇N₇O₃S₂ 分子量: 537.66

IUPAC Name: 1-(4-methylphenyl)-3-[5-[7-(3-morpholin-4-ylpropoxy)quinazolin-4-yl]sulfanyl-1,3,4-thiadiazol-2-yl]urea

SMILES: CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)SC3=NC=NC4=C3C=CC(=C4)OCCCN5CCOCC5

InChIKey: LKXFSTAQMOENSC-UHFFFAOYSA-N

InChI: InChI=1S/C25H27N7O3S2/c1-17-3-5-18(6-4-17)28-23(33)29-24-30-31-25(37-24)36-22-20-8-7-19(15-21(20)26-16-27-22)35-12-2-9-32-10-13-34-14-11-32/h3-8,15-16H,2,9-14H2,1H3,(H2,28,29,30,33)
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XL228
- 10mM in DMSO
CAS号 : 898280-07-4 Compound CID : 59757974

分子式: C₂₂H₃₁N₉O 分子量: 437.54

IUPAC Name: 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-(4-methylpiperazin-1-yl)-2-N-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]pyrimidine-2,4-diamine

SMILES: CC(C)C1=NOC(=C1)CNC2=NC(=CC(=N2)N3CCN(CC3)C)NC4=NNC(=C4)C5CC5

InChIKey: ALKJNCZNEOTEMP-UHFFFAOYSA-N

InChI: InChI=1S/C22H31N9O/c1-14(2)17-10-16(32-29-17)13-23-22-25-19(24-20-11-18(27-28-20)15-4-5-15)12-21(26-22)31-8-6-30(3)7-9-31/h10-12,14-15H,4-9,13H2,1-3H3,(H3,23,24,25,26,27,28)
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CCT137690
- 2mM in DMSO
CAS号 : 1095382-05-0(DMSO) Compound CID : 25154041

分子式: C₂₆H₃₁BrN₈O 分子量: 551.48

IUPAC Name: 3-[[4-[6-bromo-2-[4-(4-methylpiperazin-1-yl)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl]piperazin-1-yl]methyl]-5-methyl-1,2-oxazole

SMILES: CC1=CC(=NO1)CN2CCN(CC2)C3=C4C(=NC=C3Br)N=C(N4)C5=CC=C(C=C5)N6CCN(CC6)C

InChIKey: GFLQCBTXTRCREJ-UHFFFAOYSA-N

InChI: InChI=1S/C26H31BrN8O/c1-18-15-20(31-36-18)17-33-9-13-35(14-10-33)24-22(27)16-28-26-23(24)29-25(30-26)19-3-5-21(6-4-19)34-11-7-32(2)8-12-34/h3-6,15-16H,7-14,17H2,1-2H3,(H,28,29,30)
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JAK3-IN-1
- 10mM in DMSO
CAS号 : 1805787-93-2(DMSO)

分子式: C₂₆H₃₀ClN₇O₂ 分子量: 508.02

SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NCC4=CC(=CC=C4)NC(=O)C=C)Cl)OC
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JAK3-IN-1
- ≥99%
CAS号 : 1805787-93-2 Compound CID : 92042864

分子式: C₂₆H₃₀ClN₇O₂ 分子量: 508.02

IUPAC Name: N-[3-[[[5-chloro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]methyl]phenyl]prop-2-enamide

SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NCC4=CC(=CC=C4)NC(=O)C=C)Cl)OC

InChIKey: UGXCBYVBIJACEK-UHFFFAOYSA-N

InChI: InChI=1S/C26H30ClN7O2/c1-4-24(35)30-19-7-5-6-18(14-19)16-28-25-21(27)17-29-26(32-25)31-22-9-8-20(15-23(22)36-3)34-12-10-33(2)11-13-34/h4-9,14-15,17H,1,10-13,16H2,2-3H3,(H,30,35)(H2,28,29,31,32)
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FN-1501
- ≥99%
CAS号 : 1429515-59-2 Compound CID : 72195175

分子式: C₂₂H₂₅N₉O 分子量: 431.49

IUPAC Name: N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1H-pyrazole-5-carboxamide

SMILES: CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(C=NN3)NC4=NC=NC5=C4C=CN5

InChIKey: VXLAKHWYGRKCGI-UHFFFAOYSA-N

InChI: InChI=1S/C22H25N9O/c1-30-8-10-31(11-9-30)13-15-2-4-16(5-3-15)27-22(32)19-18(12-26-29-19)28-21-17-6-7-23-20(17)24-14-25-21/h2-7,12,14H,8-11,13H2,1H3,(H,26,29)(H,27,32)(H2,23,24,25,28)
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FN-1501
- 10mM in DMSO
CAS号 : 1429515-59-2(DMSO)

分子式: C₂₂H₂₅N₉O 分子量: 431.49

SMILES: CN1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=C(C=NN3)NC4=NC=NC5=C4C=CN5
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BPR1J-097 Hydrochloride
- ≥98%
CAS号 : 1327167-19-0(free base)

分子式: C₂₇H₂₉ClN₆O₃S 分子量: 553.08
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4-[2-[4-(3-Pyridin-4-ylpyrazolo[1,5-a]pyrimidin-6-yl)phenoxy]ethyl]morpholine
CAS号 : 597544-21-3 Compound CID : 5329453

分子式: C₂₃H₂₃N₅O₂ 分子量: 401.5

IUPAC Name: 4-[2-[4-(3-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-6-yl)phenoxy]ethyl]morpholine

SMILES: C1COCCN1CCOC2=CC=C(C=C2)C3=CN4C(=C(C=N4)C5=CC=NC=C5)N=C3

InChIKey: OOQJIJYKWXLQNC-UHFFFAOYSA-N

InChI: InChI=1S/C23H23N5O2/c1-3-21(30-14-11-27-9-12-29-13-10-27)4-2-18(1)20-15-25-23-22(16-26-28(23)17-20)19-5-7-24-8-6-19/h1-8,15-17H,9-14H2

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Barasertib (AZD1152-HQPA),Aurora B激酶抑制剂
- ≥97%
CAS号 : 722544-51-6 Compound CID : 16007391

分子式: C₂₆H₃₀FN₇O₃ 分子量: 507.56

IUPAC Name: 2-[3-[[7-[3-[ethyl(2-hydroxyethyl)amino]propoxy]quinazolin-4-yl]amino]-1H-pyrazol-5-yl]-N-(3-fluorophenyl)acetamide

SMILES: CCN(CCCOC1=CC2=C(C=C1)C(=NC=N2)NC3=NNC(=C3)CC(=O)NC4=CC(=CC=C4)F)CCO

InChIKey: QYZOGCMHVIGURT-UHFFFAOYSA-N

InChI: InChI=1S/C26H30FN7O3/c1-2-34(10-11-35)9-4-12-37-21-7-8-22-23(16-21)28-17-29-26(22)31-24-14-20(32-33-24)15-25(36)30-19-6-3-5-18(27)13-19/h3,5-8,13-14,16-17,35H,2,4,9-12,15H2,1H3,(H,30,36)(H2,28,29,31,32,33)
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