配体家族 - 小分子和化合物库

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罗格列酮
- ≥98%
CAS号: 122320-73-4 Compound CID : 77999

分子式: C₁₈H₁₉N₃O₃S 分子量: 357.43

IUPAC Name: 5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione

SMILES: CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=CC=N3

InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N

InChI: 1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
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苯扎贝特
- ≥98%
CAS号: 41859-67-0 EC号: 255-567-9

分子式: C₁₉H₂₀ClNO₄ 分子量: 361.82

IUPAC Name: 2-[4-[2-[(4-chlorobenzoyl)amino]ethyl]phenoxy]-2-methylpropanoic acid

SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)Cl

InChIKey: IIBYAHWJQTYFKB-UHFFFAOYSA-N

InChI: 1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)
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环丙贝特
- ≥98%(GC)
CAS号: 52214-84-3 EC号: 257-744-6

分子式: C₁₃H₁₄Cl₂O₃ 分子量: 289.15

IUPAC Name: 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CC2(Cl)Cl

InChIKey: KPSRODZRAIWAKH-UHFFFAOYSA-N

InChI: 1S/C13H14Cl2O3/c1-12(2,11(16)17)18-9-5-3-8(4-6-9)10-7-13(10,14)15/h3-6,10H,7H2,1-2H3,(H,16,17)
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吉非罗齐
- ≥99%
CAS号: 25812-30-0 EC号: 247-280-2

分子式: C₁₅H₂₂O₃ 分子量: 250.33

IUPAC Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid

SMILES: CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)O

InChIKey: HEMJJKBWTPKOJG-UHFFFAOYSA-N

InChI: 1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)
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兰雪醌
- ≥98%
CAS号: 481-42-5 Compound CID : 10205

分子式: C₁₁H₈O₃ 分子量: 188.18

IUPAC Name: 5-hydroxy-2-methylnaphthalene-1,4-dione

SMILES: CC1=CC(=O)C2=C(C1=O)C=CC=C2O

InChIKey: VCMMXZQDRFWYSE-UHFFFAOYSA-N

InChI: 1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3
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替格列扎
- ≥95%(HPLC)
CAS号: 251565-85-2 Compound CID : 208901

分子式: C₂₀H₂₄O₇S 分子量: 408.47

IUPAC Name: (2S)-2-ethoxy-3-[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoic acid

SMILES: CCOC(CC1=CC=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)O

InChIKey: CXGTZJYQWSUFET-IBGZPJMESA-N

InChI: 1S/C20H24O7S/c1-3-25-19(20(21)22)14-16-6-8-17(9-7-16)26-13-12-15-4-10-18(11-5-15)27-28(2,23)24/h4-11,19H,3,12-14H2,1-2H3,(H,21,22)/t19-/m0/s1
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CF53
- 10mM in DMSO
CAS号: 1808160-52-2 Compound CID : 118340554

分子式: C₂₄H₂₅N₇O₂ 分子量: 443.50
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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)
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GNE-207
- ≥97%
CAS号: 2158266-58-9 Compound CID : 132186469

分子式: C₂₉H₃₀N₆O₃ 分子量: 510.59

IUPAC Name: 5-[8-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]isoquinolin-3-yl]-N-methylpyridine-2-carboxamide

SMILES: CC(=O)N1CCC2=C(C1)C(=NN2C3CCOCC3)C4=CC=CC5=CC(=NC=C54)C6=CN=C(C=C6)C(=O)NC

InChIKey: MUJXZEDIWKGKQD-UHFFFAOYSA-N

InChI: 1S/C29H30N6O3/c1-18(36)34-11-8-27-24(17-34)28(33-35(27)21-9-12-38-13-10-21)22-5-3-4-19-14-26(32-16-23(19)22)20-6-7-25(31-15-20)29(37)30-2/h3-7,14-16,21H,8-13,17H2,1-2H3,(H,30,37)
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DCH36_06
- ≥99%
CAS号: 593273-05-3 Compound CID : 1797299

分子式: C₁₈H₁₃ClN₂O₃S 分子量: 372.83

IUPAC Name: (5E)-1-(3-chloro-4-methylphenyl)-5-[(E)-3-(furan-2-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

SMILES: CC1=C(C=C(C=C1)N2C(=O)C(=CC=CC3=CC=CO3)C(=O)NC2=S)Cl

InChIKey: AYNCXNUUERDREH-FMDPHQNASA-N

InChI: 1S/C18H13ClN2O3S/c1-11-7-8-12(10-15(11)19)21-17(23)14(16(22)20-18(21)25)6-2-4-13-5-3-9-24-13/h2-10H,1H3,(H,20,22,25)/b4-2+,14-6+
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CPI-1612
- ≥99%
CAS号: 2374971-81-8 Compound CID : 146014965

分子式: C₂₇H₂₆N₆O 分子量: 450.53

IUPAC Name: (2R)-2-[[(2S)-2-(4-cyanophenyl)propyl]amino]-N-[5-(1-methylpyrazol-4-yl)pyridin-2-yl]-2-phenylacetamide

SMILES: CC(CNC(C1=CC=CC=C1)C(=O)NC2=NC=C(C=C2)C3=CN(N=C3)C)C4=CC=C(C=C4)C#N

InChIKey: SEDFZSHSBUXKAC-NIYFSFCBSA-N

InChI: 1S/C27H26N6O/c1-19(21-10-8-20(14-28)9-11-21)15-30-26(22-6-4-3-5-7-22)27(34)32-25-13-12-23(16-29-25)24-17-31-33(2)18-24/h3-13,16-19,26,30H,15H2,1-2H3,(H,29,32,34)/t19-,26-/m1/s1
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GNE-049
- ≥98%
CAS号: 1936421-41-8 Compound CID : 121373418

分子式: C₂₇H₃₂F₂N₆O₂ 分子量: 510.58

IUPAC Name: 1-[3-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

SMILES: CC(=O)N1CCC2=C(C1)C(=NN2C3CCOCC3)N4CCCC5=CC(=C(C=C54)C(F)F)C6=CN(N=C6)C

InChIKey: LWXLECMNBTVASW-UHFFFAOYSA-N

InChI: 1S/C27H32F2N6O2/c1-17(36)33-9-5-24-23(16-33)27(31-35(24)20-6-10-37-11-7-20)34-8-3-4-18-12-21(19-14-30-32(2)15-19)22(26(28)29)13-25(18)34/h12-15,20,26H,3-11,16H2,1-2H3
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