激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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SNS-314 甲磺酸盐
- ≥98%
CAS号 : 1146618-41-8 Compound CID : 24995523

分子式: C₁₈H₁₅ClN₆OS₂.CH₄O₃S 分子量: 527.04

IUPAC Name: 1-(3-chlorophenyl)-3-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]-1,3-thiazol-2-yl]urea;methanesulfonic acid

SMILES: CS(=O)(=O)O.C1=CC(=CC(=C1)Cl)NC(=O)NC2=NC=C(S2)CCNC3=NC=NC4=C3SC=C4

InChIKey: FYCODPVDEFFWSR-UHFFFAOYSA-N

InChI: InChI=1S/C18H15ClN6OS2.CH4O3S/c19-11-2-1-3-12(8-11)24-17(26)25-18-21-9-13(28-18)4-6-20-16-15-14(5-7-27-15)22-10-23-16;1-5(2,3)4/h1-3,5,7-10H,4,6H2,(H,20,22,23)(H2,21,24,25,26);1H3,(H,2,3,4)
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XL335
- ≥98%
CAS号 : 629664-81-9 Compound CID : 10026128

分子式: C₂₅H₂₄F₂N₂O₃ 分子量: 438.48

IUPAC Name: propan-2-yl 3-(3,4-difluorobenzoyl)-1,1-dimethyl-2,6-dihydroazepino[4,5-b]indole-5-carboxylate

SMILES: CC(C)OC(=O)C1=CN(CC(C2=C1NC3=CC=CC=C32)(C)C)C(=O)C4=CC(=C(C=C4)F)F

InChIKey: INASOKQDNHHMRE-UHFFFAOYSA-N

InChI: InChI=1S/C25H24F2N2O3/c1-14(2)32-24(31)17-12-29(23(30)15-9-10-18(26)19(27)11-15)13-25(3,4)21-16-7-5-6-8-20(16)28-22(17)21/h5-12,14,28H,13H2,1-4H3
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XL228
- ≥98%
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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鹅去氧胆酸
- ≥98%
CAS号 : 474-25-9

分子式: C₂₄H₄₀O₄ 分子量: 392.58

IUPAC Name: (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C

InChIKey: RUDATBOHQWOJDD-BSWAIDMHSA-N

InChI: InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
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GW441756,TrKA受体酪氨酸激酶抑制剂
- ≥98%
CAS号 : 504433-23-2 Compound CID : 9943465

分子式: C₁₇H₁₃N₃O 分子量: 275.3

IUPAC Name: (3Z)-3-[(1-methylindol-3-yl)methylidene]-1H-pyrrolo[3,2-b]pyridin-2-one

SMILES: CN1C=C(C2=CC=CC=C21)C=C3C4=C(C=CC=N4)NC3=O

InChIKey: NXNQLECPAXXYTR-LCYFTJDESA-N

InChI: InChI=1S/C17H13N3O/c1-20-10-11(12-5-2-3-7-15(12)20)9-13-16-14(19-17(13)21)6-4-8-18-16/h2-10H,1H3,(H,19,21)/b13-9-
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PF 06273340,Pan-Trk抑制剂
- ≥98%(HPLC)
CAS号 : 1402438-74-7 Compound CID : 66571548

分子式: C₂₃H₂₂ClN₇O₃ 分子量: 479.93

IUPAC Name: N-[5-[2-amino-7-(1-hydroxy-2-methylpropan-2-yl)pyrrolo[2,3-d]pyrimidine-5-carbonyl]pyridin-3-yl]-2-(5-chloropyridin-2-yl)acetamide

SMILES: CC(C)(CO)N1C=C(C2=CN=C(N=C21)N)C(=O)C3=CC(=CN=C3)NC(=O)CC4=NC=C(C=C4)Cl

InChIKey: BPIWZDNVMQQBQX-UHFFFAOYSA-N

InChI: InChI=1S/C23H22ClN7O3/c1-23(2,12-32)31-11-18(17-10-28-22(25)30-21(17)31)20(34)13-5-16(9-26-7-13)29-19(33)6-15-4-3-14(24)8-27-15/h3-5,7-11,32H,6,12H2,1-2H3,(H,29,33)(H2,25,28,30)
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DY 268,FXR拮抗剂
- ≥98%(HPLC)
CAS号 : 1609564-75-1 Compound CID : 90656831

分子式: C₃₀H₃₂N₄O₅S 分子量: 560.66

IUPAC Name: 1-[(3-methoxyphenyl)methyl]-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-(4-methylphenyl)pyrazole-4-carboxamide

SMILES: CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=C(C=C3)C)S(=O)(=O)N4CCOCC4)CC5=CC(=CC=C5)OC

InChIKey: KQSPAAPFKIEUGH-UHFFFAOYSA-N

InChI: InChI=1S/C30H32N4O5S/c1-21-7-10-24(11-8-21)29-27(20-33(32-29)19-23-5-4-6-26(17-23)38-3)30(35)31-25-12-9-22(2)28(18-25)40(36,37)34-13-15-39-16-14-34/h4-12,17-18,20H,13-16,19H2,1-3H3,(H,31,35)
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AZD1480
- 10mM in DMSO
CAS号 : 935666-88-9(DMSO)

分子式: C₁₄H₁₄ClFN₈ 分子量: 348.77

SMILES: CC(NC1=NC=C(Cl)C(=N1)NC2=N[NH]C(=C2)C)C3=NC=C(F)C=N3
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BMS-754807
- 10mM in DMSO
CAS号 : 1001350-96-4(DMSO)

分子式: C₂₃H₂₄FN₉O 分子量: 461.49

SMILES: CC1(CCCN1C2=N[N]3C=CC=C3C(=N2)NC4=N[NH]C(=C4)C5CC5)C(=O)NC6=CC=C(F)N=C6
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Bosutinib (SKI-606)
- 10mM in DMSO
CAS号 : 380843-75-4(DMSO)

分子式: C₂₆H₂₉Cl₂N₅O₃ 分子量: 530.45

SMILES: COC1=C(Cl)C=C(Cl)C(=C1)NC2=C(C=NC3=CC(=C(OC)C=C23)OCCCN4CCN(C)CC4)C#N
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CFI-400945
- 10mM in DMSO
CAS号 : 1338806-73-7(DMSO)

分子式: C₃₃H₃₄N₄O₃ 分子量: 534.65

SMILES: COC1=CC2=C(NC(=O)C23CC3C4=CC=C5C(=C4)[NH]N=C5\C=C\C6=CC=C(CN7CC(C)OC(C)C7)C=C6)C=C1
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Entrectinib (RXDX-101)
- 10mM in DMSO
CAS号 : 1108743-60-7(DMSO)

分子式: C₃₁H₃₄F₂N₆O₂ 分子量: 560.64

SMILES: CN1CCN(CC1)C2=CC=C(C(=O)NC3=N[NH]C4=C3C=C(CC5=CC(=CC(=C5)F)F)C=C4)C(=C2)NC6CCOCC6
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