激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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双氢麦角胺甲磺酸盐
- ≥98%
CAS号 : 6190-39-2 Compound CID : 71171

分子式: C₃₃H₃₇N₅O₅·CH₄O₃S 分子量: 679.79

IUPAC Name: (6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;methanesulfonic acid

SMILES: CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O

InChIKey: ADYPXRFPBQGGAH-UMYZUSPBSA-N

InChI: InChI=1S/C33H37N5O5.CH4O3S/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32;1-5(2,3)4/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39);1H3,(H,2,3,4)/t21-,23-,25-,26+,27+,32-,33+;/m1./s1
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5-羟基色胺
- ≥98%(HPLC)
CAS号 : 50-67-9 Compound CID : 5202

分子式: C₁₀H₁₂N₂O 分子量: 176.22

IUPAC Name: 3-(2-aminoethyl)-1H-indol-5-ol

SMILES: C1=CC2=C(C=C1O)C(=CN2)CCN

InChIKey: QZAYGJVTTNCVMB-UHFFFAOYSA-N

InChI: InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2
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PD-1 / PD-L1抑制剂1
- ≥98%
CAS号 : 1675201-83-8 Compound CID : 91663303

分子式: C₂₉H₃₃NO₅ 分子量: 475.6

IUPAC Name: (2S)-1-[[2,6-dimethoxy-4-[(2-methyl-3-phenylphenyl)methoxy]phenyl]methyl]piperidine-2-carboxylic acid

SMILES: CC1=C(C=CC=C1C2=CC=CC=C2)COC3=CC(=C(C(=C3)OC)CN4CCCCC4C(=O)O)OC

InChIKey: ZBOYJODMIAUJHH-SANMLTNESA-N

InChI: InChI=1S/C29H33NO5/c1-20-22(12-9-13-24(20)21-10-5-4-6-11-21)19-35-23-16-27(33-2)25(28(17-23)34-3)18-30-15-8-7-14-26(30)29(31)32/h4-6,9-13,16-17,26H,7-8,14-15,18-19H2,1-3H3,(H,31,32)/t26-/m0/s1
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GR 46611,5-HT 1B / 1D激动剂
- ≥97%
CAS号 : 185259-85-2 Compound CID : 6160690

分子式: C₂₃H₂₇N₃O₂ 分子量: 377.49

IUPAC Name: (E)-3-[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]-N-[(4-methoxyphenyl)methyl]prop-2-enamide

SMILES: CN(C)CCC1=CNC2=C1C=C(C=C2)C=CC(=O)NCC3=CC=C(C=C3)OC

InChIKey: LBVZWEWTNUDWNS-YRNVUSSQSA-N

InChI: InChI=1S/C23H27N3O2/c1-26(2)13-12-19-16-24-22-10-6-17(14-21(19)22)7-11-23(27)25-15-18-4-8-20(28-3)9-5-18/h4-11,14,16,24H,12-13,15H2,1-3H3,(H,25,27)/b11-7+
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PNU 142633,5-HT1激动剂
- ≥98%(HPLC)
CAS号 : 187665-65-2 Compound CID : 9845148

分子式: C₂₄H₃₀N₄O₃ 分子量: 422.53

IUPAC Name: (1S)-1-[2-[4-(4-carbamoylphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide

SMILES: CNC(=O)C1=CC2=C(C=C1)C(OCC2)CCN3CCN(CC3)C4=CC=C(C=C4)C(=O)N

InChIKey: PNTVCCRNJOGKGA-QFIPXVFZSA-N

InChI: InChI=1S/C24H30N4O3/c1-26-24(30)19-4-7-21-18(16-19)9-15-31-22(21)8-10-27-11-13-28(14-12-27)20-5-2-17(3-6-20)23(25)29/h2-7,16,22H,8-15H2,1H3,(H2,25,29)(H,26,30)/t22-/m0/s1
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BMS202（PD-1 / PD-L1抑制剂2）
- 10mM in DMSO
CAS号 : 1675203-84-5(DMSO)

分子式: C₂₅H₂₉N₃O₃ 分子量: 419.52

SMILES: COC1=C(CNCCNC(C)=O)C=CC(=N1)OCC2=C(C)C(=CC=C2)C3=CC=CC=C3
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BRL-15572 Dihydrochloride
- 10mM in DMSO
CAS号 : 193611-72-2(DMSO)

分子式: C₂₅H₂₇ClN₂O·2HCl 分子量: 479.87

SMILES: Cl.Cl.OC(CN1CCN(CC1)C2=CC(=CC=C2)Cl)C(C3=CC=CC=C3)C4=CC=CC=C4
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佐米曲坦
- 10mM in DMSO
CAS号 : 139264-17-8(DMSO)

分子式: C₁₆H₂₁N₃O₂ 分子量: 287.36

SMILES: CN(C)CCC1=C[NH]C2=C1C=C(CC3COC(=O)N3)C=C2
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氟哌啶醇
- 10mM in DMSO
CAS号 : 52-86-8(DMSO)

分子式: C₂₁H₂₃ClFNO₂ 分子量: 375.86

SMILES: OC1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)C3=CC=C(Cl)C=C3
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阿立哌唑
- 10mM in DMSO
CAS号 : 129722-12-9(DMSO)

分子式: C₂₃H₂₇Cl₂N₃O₂ 分子量: 448.39

SMILES: ClC1=CC=CC(=C1Cl)N2CCN(CCCCOC3=CC=C4CCC(=O)NC4=C3)CC2
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BMS-1001
- ≥98%
CAS号 : 2113650-03-4 Compound CID : 131839624

分子式: C₃₅H₃₄N₂O₇ 分子量: 594.65

IUPAC Name: (2R)-2-[[2-[(3-cyanophenyl)methoxy]-4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylphenyl]methoxy]-5-methylphenyl]methylamino]-3-hydroxypropanoic acid

SMILES: CC1=CC(=C(C=C1OCC2=C(C(=CC=C2)C3=CC4=C(C=C3)OCCO4)C)OCC5=CC(=CC=C5)C#N)CNC(CO)C(=O)O

InChIKey: UWNXGZKSIKQKAH-SSEXGKCCSA-N

InChI: InChI=1S/C35H34N2O7/c1-22-13-28(18-37-30(19-38)35(39)40)33(43-20-25-6-3-5-24(14-25)17-36)16-32(22)44-21-27-7-4-8-29(23(27)2)26-9-10-31-34(15-26)42-12-11-41-31/h3-10,13-16,30,37-38H,11-12,18-21H2,1-2H3,(H,39,40)/t30-/m1/s1
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BMS-1166
- 10mM in DMSO
CAS号 : 1818314-88-3 Compound CID : 118434635

分子式: C₃₆H₃₃ClN₂O₇ 分子量: 641.11

IUPAC Name: (2R,4R)-1-[[5-chloro-2-[(3-cyanophenyl)methoxy]-4-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylphenyl]methoxy]phenyl]methyl]-4-hydroxypyrrolidine-2-carboxylic acid

SMILES: CC1=C(C=CC=C1C2=CC3=C(C=C2)OCCO3)COC4=C(C=C(C(=C4)OCC5=CC(=CC=C5)C#N)CN6CC(CC6C(=O)O)O)Cl

InChIKey: QBXVXKRWOVBUDB-GRKNLSHJSA-N

InChI: InChI=1S/C36H33ClN2O7/c1-22-26(6-3-7-29(22)25-8-9-32-35(14-25)44-11-10-43-32)21-46-34-16-33(45-20-24-5-2-4-23(12-24)17-38)27(13-30(34)37)18-39-19-28(40)15-31(39)36(41)42/h2-9,12-14,16,28,31,40H,10-11,15,18-21H2,1H3,(H,41,42)/t28-,31-/m1/s1
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