配体家族 - 小分子和化合物库

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思瑞德林
- ≥99%
CAS号: 1448867-41-1

分子式: C₂₆H₂₄Cl₂N₆O₄ 分子量: 555.41

IUPAC Name: (4S)-5-(5-chloro-1-methyl-2-oxopyridin-3-yl)-4-(4-chlorophenyl)-2-(2,4-dimethoxypyrimidin-5-yl)-3-propan-2-yl-4H-pyrrolo[3,4-d]imidazol-6-one

SMILES: CC(C)N1C2=C(C(=O)N(C2C3=CC=C(C=C3)Cl)C4=CC(=CN(C4=O)C)Cl)N=C1C5=CN=C(N=C5OC)OC

InChIKey: AGBSXNCBIWWLHD-FQEVSTJZSA-N

InChI: 1S/C26H24Cl2N6O4/c1-13(2)33-21-19(30-22(33)17-11-29-26(38-5)31-23(17)37-4)25(36)34(18-10-16(28)12-32(3)24(18)35)20(21)14-6-8-15(27)9-7-14/h6-13,20H,1-5H3/t20-/m0/s1
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MG-277
Compound CID : 139600332

SMILES: C1CCC2(CC1)[C@@]1([C@H]([C@@H](N2)C(=O)NCCCCCc2c3CN(C(=O)c3ccc2)C2CCC(=O)NC2=O)c2c(c(ccc2)Cl)F)c2c(cc(cc2)Cl)NC1=O

InChIKey: BANRYGZZIMCKNA-OYGJEQPESA-N

InChI: 1S/C41H42Cl2FN5O5/c42-24-14-15-28-30(21-24)46-39(54)41(28)33(26-12-8-13-29(43)34(26)44)35(48-40(41)18-4-2-5-19-40)37(52)45-20-6-1-3-9-23-10-7-11-25-27(23)22-49(38(25)53)31-16-17-32(50)47-36(31)51/h7-8See more
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MI-773
- 10mM in DMSO
CAS号: 1303607-07-9

分子式: C₂₉H₃₄Cl₂FN₃O₃ 分子量: 562.5
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GSK321
- ≥99%
CAS号: 1816331-63-1 Compound CID : 91864709

分子式: C₂₈H₂₈FN₅O₃ 分子量: 501.55

IUPAC Name: (7R)-1-[(4-fluorophenyl)methyl]-N-[3-[(1S)-1-hydroxyethyl]phenyl]-7-methyl-5-(1H-pyrrole-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

SMILES: CC1CN(CC2=C1N(N=C2C(=O)NC3=CC=CC(=C3)C(C)O)CC4=CC=C(C=C4)F)C(=O)C5=CC=CN5

InChIKey: IVFDDVKCCBDPQZ-MSOLQXFVSA-N

InChI: 1S/C28H28FN5O3/c1-17-14-33(28(37)24-7-4-12-30-24)16-23-25(27(36)31-22-6-3-5-20(13-22)18(2)35)32-34(26(17)23)15-19-8-10-21(29)11-9-19/h3-13,17-18,30,35H,14-16H2,1-2H3,(H,31,36)/t17-,18+/m1/s1
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Milademetan
- ≥98%
CAS号: 1398568-47-2 Compound CID : 73297272

分子式: C₃₀H₃₄Cl₂FN₅O₄ 分子量: 618.53

SMILES: CC1(CCC2(CC1)C3(C(C(N2)C(=O)NC4CCC(OC4)C(=O)N)C5=C(C(=NC=C5)Cl)F)C6=C(C=C(C=C6)Cl)NC3=O)C

InChIKey: RYAYYVTWKAOAJF-QISPRATLSA-N

InChI: 1S/C30H34Cl2FN5O4/c1-28(2)8-10-29(11-9-28)30(18-5-3-15(31)13-19(18)37-27(30)41)21(17-7-12-35-24(32)22(17)33)23(38-29)26(40)36-16-4-6-20(25(34)39)42-14-16/h3,5,7,12-13,16,20-21,23,38H,4,6,8-11,14H2,1-2See more
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MI-773
- ≥98%
CAS号: 1303607-07-9

分子式: C₂₉H₃₄Cl₂FN₃O₃ 分子量: 562.5

IUPAC Name: (2'R,3S,3'S,5'R)-6-chloro-3'-(3-chloro-2-fluorophenyl)-5'-(2,2-dimethylpropyl)-N-(4-hydroxycyclohexyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide

SMILES: CC(C)(C)CC1C2(C(C(N1)C(=O)NC3CCC(CC3)O)C4=C(C(=CC=C4)Cl)F)C5=C(C=C(C=C5)Cl)NC2=O

InChIKey: IDKAKZRYYDCJDU-YJRDPZTCSA-N

InChI: 1S/C29H34Cl2FN3O3/c1-28(2,3)14-22-29(19-12-7-15(30)13-21(19)34-27(29)38)23(18-5-4-6-20(31)24(18)32)25(35-22)26(37)33-16-8-10-17(36)11-9-16/h4-7,12-13,16-17,22-23,25,35-36H,8-11,14H2,1-3H3,(H,33,37)(H,See more
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IDH1 Inhibitor 1
- ≥99%
CAS号: 2234285-81-3 Compound CID : 137333448

分子式: C₂₀H₁₈F₄N₆O₂ 分子量: 450.39

IUPAC Name: (4R)-4-(fluoromethyl)-3-[2-[[(1S)-1-[1-[4-(trifluoromethyl)phenyl]imidazol-4-yl]ethyl]amino]pyrimidin-4-yl]-1,3-oxazolidin-2-one

SMILES: CC(C1=CN(C=N1)C2=CC=C(C=C2)C(F)(F)F)NC3=NC=CC(=N3)N4C(COC4=O)CF

InChIKey: ULTZLMKTFYRMFK-WFASDCNBSA-N

InChI: 1S/C20H18F4N6O2/c1-12(16-9-29(11-26-16)14-4-2-13(3-5-14)20(22,23)24)27-18-25-7-6-17(28-18)30-15(8-21)10-32-19(30)31/h2-7,9,11-12,15H,8,10H2,1H3,(H,25,27,28)/t12-,15-/m0/s1
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MI-1061
- ≥99%
CAS号: 1410737-34-6 Compound CID : 70677271

分子式: C₃₀H₂₆Cl₂FN₃O₄ 分子量: 582.45

SMILES: C1CCC2(CC1)C3(C(C(N2)C(=O)NC4=CC=C(C=C4)C(=O)O)C5=C(C(=CC=C5)Cl)F)C6=C(C=C(C=C6)Cl)NC3=O

InChIKey: BIDSEXPFIMKDMF-LOLKONATSA-N

InChI: 1S/C30H26Cl2FN3O4/c31-17-9-12-20-22(15-17)35-28(40)30(20)23(19-5-4-6-21(32)24(19)33)25(36-29(30)13-2-1-3-14-29)26(37)34-18-10-7-16(8-11-18)27(38)39/h4-12,15,23,25,36H,1-3,13-14H2,(H,34,37)(H,35,40)(H,See more
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IDH889
- ≥98%
CAS号: 1429179-07-6 Compound CID : 71542286

分子式: C₂₃H₂₅FN₆O₂ 分子量: 436.48

IUPAC Name: (4S)-3-[2-[[(1S)-1-[5-(4-fluoro-3-methylphenyl)pyrimidin-2-yl]ethyl]amino]pyrimidin-4-yl]-4-propan-2-yl-1,3-oxazolidin-2-one

SMILES: CC1=C(C=CC(=C1)C2=CN=C(N=C2)C(C)NC3=NC=CC(=N3)N4C(COC4=O)C(C)C)F

InChIKey: JDCYIMQAIKEACU-HNAYVOBHSA-N

InChI: 1S/C23H25FN6O2/c1-13(2)19-12-32-23(31)30(19)20-7-8-25-22(29-20)28-15(4)21-26-10-17(11-27-21)16-5-6-18(24)14(3)9-16/h5-11,13,15,19H,12H2,1-4H3,(H,25,28,29)/t15-,19+/m0/s1
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MI-1061
- 10mM in DMSO
CAS号: 1410737-34-6 Compound CID : 70677271

分子式: C₃₀H₂₆Cl₂FN₃O₄ 分子量: 582.45
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Milademetan
- 10mM in DMSO
CAS号: 1398568-47-2 Compound CID : 73297272

分子式: C₃₀H₃₄Cl₂FN₅O₄ 分子量: 618.53
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IDH889
- 10mM in DMSO
CAS号: 1429179-07-6 Compound CID : 71542286

分子式: C₂₃H₂₅FN₆O₂ 分子量: 436.48
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