配体家族 - 小分子和化合物库

收藏夹比较
OTX015,BET溴结构域抑制剂
- ≥98%
CAS号: 202590-98-5

分子式: C₂₅H₂₂ClN₅O₂S 分子量: 491.99

IUPAC Name: 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-(4-hydroxyphenyl)acetamide

SMILES: CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)NC4=CC=C(C=C4)O)C5=CC=C(C=C5)Cl)C

InChIKey: GNMUEVRJHCWKTO-FQEVSTJZSA-N

InChI: 1S/C25H22ClN5O2S/c1-13-14(2)34-25-22(13)23(16-4-6-17(26)7-5-16)28-20(24-30-29-15(3)31(24)25)12-21(33)27-18-8-10-19(32)11-9-18/h4-11,20,32H,12H2,1-3H3,(H,27,33)/t20-/m0/s1
详情

查看价格关闭
收藏夹比较
氟马西尼
- ≥99%(HPLC)
CAS号: 78755-81-4 EC号: 616-650-9

分子式: C₁₅H₁₄FN₃O₃ 分子量: 303.29

IUPAC Name: ethyl 8-fluoro-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

SMILES: CCOC(=O)C1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C

InChIKey: OFBIFZUFASYYRE-UHFFFAOYSA-N

InChI: 1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3
详情

查看价格关闭
收藏夹比较
ARV-771
- ≥98%
CAS号: 1949837-12-0

分子式: C₄₉H₆₀ClN₉O₇S₂ 分子量: 986.64

IUPAC Name: (2S,4R)-1-[(2S)-2-[[2-[3-[2-[[2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetyl]amino]ethoxy]propoxy]acetyl]amino]-3,3-See more

SMILES: CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)NCCOCCCOCC(=O)NC(C(=O)N4CC(CC4C(=O)NC(C)C5=CC=C(C=C5)C6=C(N=CS6)C)O)C(C)(C)C)C7=CC=C(C=C7)Cl)C

InChIKey: PQOGZKGXGLHDGS-QQRWPDCKSA-N

InChI: 1S/C49H60ClN9O7S2/c1-27-30(4)68-48-41(27)42(33-14-16-35(50)17-15-33)54-37(45-57-56-31(5)59(45)48)23-39(61)51-18-21-65-19-9-20-66-25-40(62)55-44(49(6,7)8)47(64)58-24-36(60)22-38(58)46(63)53-28(2)32-10-See more
详情

查看价格关闭
收藏夹比较
SIM1
Compound CID : 156022820

IUPAC Name: N,N'-(11-((2-(((S)-1-((2S,4R)-4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)- 3,3-dimethyl-1-oxobutan-2-yl)amino)-2-oxoethoxy)methyl)-11-methyl-3,6,9,13,16,19- hexaoxahenicosaSee more

SMILES: O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)NC(=O)COCC(COCCOCCOCCNC(=O)C[C@H]1c2n(c3c(C(=N1)c1ccc(cc1)Cl)c(c(s3)C)C)c(nn2)C)(COCCOCCOCCNC(=O)C[C@H]1c2n(c3c(C(=N1)c1ccc(cc1)Cl)c(c(s3)C)C)c(nn2)C)C)C(=O)NCcSee more

InChIKey: RARNTROXRCXFHV-CMRSQZKGSA-N

InChI: 1S/C79H98Cl2N14O13S3/c1-46-49(4)110-76-66(46)68(54-16-20-57(80)21-17-54)86-60(72-91-89-51(6)94(72)76)37-63(97)82-24-26-102-28-30-104-32-34-106-42-79(11,44-108-41-65(99)88-71(78(8,9)10)75(101)93-40-59(See more
详情

查看价格关闭
收藏夹比较
HJB97
- 10mM in DMSO
CAS号: 2093391-24-1 Compound CID : 135397673

分子式: C₂₆H₂₈N₈O₃ 分子量: 500.55
详情

查看价格关闭
收藏夹比较
CF53
- 10mM in DMSO
CAS号: 1808160-52-2 Compound CID : 118340554

分子式: C₂₄H₂₅N₇O₂ 分子量: 443.50
详情

查看价格关闭
收藏夹比较
AZD-6280
- 10mM in DMSO
CAS号: 942436-93-3 Compound CID : 23630026

分子式: C₂₀H₂₂N₄O₃ 分子量: 366.41
详情

查看价格关闭
收藏夹比较
CF53
- ≥99%
CAS号: 1808160-52-2 Compound CID : 118340554

分子式: C₂₄H₂₅N₇O₂ 分子量: 443.50

IUPAC Name: N-(5-cyclopropyl-2-methylpyrazol-3-yl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-2-methyl-9H-pyrimido[4,5-b]indol-4-amine

SMILES: CC1=C(C(=NO1)C)C2=C(C=C3C(=C2)NC4=C3C(=NC(=N4)C)NC5=CC(=NN5C)C6CC6)OC

InChIKey: JIYPVUCBRQNICX-UHFFFAOYSA-N

InChI: 1S/C24H25N7O2/c1-11-21(12(2)33-30-11)16-8-18-15(9-19(16)32-5)22-23(27-18)25-13(3)26-24(22)28-20-10-17(14-6-7-14)29-31(20)4/h8-10,14H,6-7H2,1-5H3,(H2,25,26,27,28)
详情

查看价格关闭
收藏夹比较
Afizagabar
- ≥98%
CAS号: 1398496-82-6 Compound CID : 136209703

分子式: C₁₉H₁₂FN₃O₂S 分子量: 365.38

IUPAC Name: 5-(4-fluoro-1-benzothiophen-2-yl)-8-methyl-1,9-dihydro-[1,3]oxazolo[4,5-h][2,3]benzodiazepin-2-one

SMILES: CC1=NN=C(C2=CC3=C(C=C2C1)NC(=O)O3)C4=CC5=C(C=CC=C5S4)F

InChIKey: WNUWGRVHGICCLS-UHFFFAOYSA-N

InChI: 1S/C19H12FN3O2S/c1-9-5-10-6-14-15(25-19(24)21-14)7-11(10)18(23-22-9)17-8-12-13(20)3-2-4-16(12)26-17/h2-4,6-8H,5H2,1H3,(H,21,24)
详情

查看价格关闭
收藏夹比较
AZD-6280
- ≥98%
CAS号: 942436-93-3 Compound CID : 23630026

分子式: C₂₀H₂₂N₄O₃ 分子量: 366.41

IUPAC Name: 4-amino-8-(2,5-dimethoxyphenyl)-N-propylcinnoline-3-carboxamide

SMILES: CCCNC(=O)C1=NN=C2C(=C1N)C=CC=C2C3=C(C=CC(=C3)OC)OC

InChIKey: NVWCZRPXYVDQEE-UHFFFAOYSA-N

InChI: 1S/C20H22N4O3/c1-4-10-22-20(25)19-17(21)14-7-5-6-13(18(14)23-24-19)15-11-12(26-2)8-9-16(15)27-3/h5-9,11H,4,10H2,1-3H3,(H2,21,23)(H,22,25)
详情

查看价格关闭
收藏夹比较
HJB97
- ≥98%
CAS号: 2093391-24-1 Compound CID : 135397673

分子式: C₂₆H₂₈N₈O₃ 分子量: 500.55

IUPAC Name: 4-[(5-cyclopropyl-2-ethylpyrazol-3-yl)amino]-7-(3,5-dimethyl-1,2-oxazol-4-yl)-6-methoxy-N-methyl-9H-pyrimido[4,5-b]indole-2-carboxamide

SMILES: CCN1C(=CC(=N1)C2CC2)NC3=NC(=NC4=C3C5=CC(=C(C=C5N4)C6=C(ON=C6C)C)OC)C(=O)NC

InChIKey: JNYHQYRTYFSMSQ-UHFFFAOYSA-N

InChI: 1S/C26H28N8O3/c1-6-34-20(11-17(32-34)14-7-8-14)29-24-22-15-10-19(36-5)16(21-12(2)33-37-13(21)3)9-18(15)28-23(22)30-25(31-24)26(35)27-4/h9-11,14H,6-8H2,1-5H3,(H,27,35)(H2,28,29,30,31)
详情

查看价格关闭
收藏夹比较
Afizagabar
- 10mM in DMSO
CAS号: 1398496-82-6 Compound CID : 136209703

分子式: C₁₉H₁₂FN₃O₂S 分子量: 365.38
详情

查看价格关闭