配体家族 - 小分子和化合物库

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渥曼青霉素
- ≥98%
CAS号: 19545-26-7 Compound CID : 312145

分子式: C₂₃H₂₄O₈ 分子量: 428.43

IUPAC Name: [(1R,3R,5S,9R,18S)-18-(methoxymethyl)-1,5-dimethyl-6,11,16-trioxo-13,17-dioxapentacyclo[10.6.1.02,10.05,9.015,19]nonadeca-2(10),12(19),14-trien-3-yl] acetate

SMILES: CC(=O)OC1CC2(C(CCC2=O)C3=C1C4(C(OC(=O)C5=COC(=C54)C3=O)COC)C)C

InChIKey: QDLHCMPXEPAAMD-QAIWCSMKSA-N

InChI: 1S/C23H24O8/c1-10(24)30-13-7-22(2)12(5-6-14(22)25)16-18(13)23(3)15(9-28-4)31-21(27)11-8-29-20(17(11)23)19(16)26/h8,12-13,15H,5-7,9H2,1-4H3/t12-,13+,15+,22-,23-/m0/s1
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PBIT,JARID1（Jumonji AT-Rich交互式域1）抑制剂
- ≥98%(HPLC)
CAS号: 2514-30-9 Compound CID : 935415

分子式: C₁₄H₁₁NOS 分子量: 241.31

IUPAC Name: 2-(4-methylphenyl)-1,2-benzothiazol-3-one

SMILES: CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3S2

InChIKey: KRXMYBAZKJBJAB-UHFFFAOYSA-N

InChI: 1S/C14H11NOS/c1-10-6-8-11(9-7-10)15-14(16)12-4-2-3-5-13(12)17-15/h2-9H,1H3
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PIK-108
- 10mM in DMSO
CAS号: 901398-68-3 Compound CID : 70686584

分子式: C₂₂H₂₄N₂O₃ 分子量: 364.44
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SAR-260301
- 10mM in DMSO
CAS号: 1260612-13-2 Compound CID : 135565159

分子式: C₁₉H₂₂N₄O₃ 分子量: 354.40
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NSC781406
- 10mM in DMSO
CAS号: 1676893-24-5 Compound CID : 127025628

分子式: C₂₉H₂₇F₂N₅O₅S₂ 分子量: 627.68
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KDM5A-IN-1
- 10mM in DMSO
CAS号: 1905481-36-8 Compound CID : 119081409

分子式: C₁₅H₂₂N₄O₂ 分子量: 290.36
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NSC781406
- ≥99%
CAS号: 1676893-24-5 Compound CID : 127025628

分子式: C₂₉H₂₇F₂N₅O₅S₂ 分子量: 627.68

IUPAC Name: 2,4-difluoro-N-[2-methoxy-5-[4-[3-(4-methylsulfonylpiperazin-1-yl)prop-1-ynyl]quinolin-6-yl]pyridin-3-yl]benzenesulfonamide

SMILES: COC1=C(C=C(C=N1)C2=CC3=C(C=CN=C3C=C2)C#CCN4CCN(CC4)S(=O)(=O)C)NS(=O)(=O)C5=C(C=C(C=C5)F)F

InChIKey: BBRINJUWZRLWKK-UHFFFAOYSA-N

InChI: 1S/C29H27F2N5O5S2/c1-41-29-27(34-43(39,40)28-8-6-23(30)18-25(28)31)17-22(19-33-29)21-5-7-26-24(16-21)20(9-10-32-26)4-3-11-35-12-14-36(15-13-35)42(2,37)38/h5-10,16-19,34H,11-15H2,1-2H3
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KDM5A-IN-1
- ≥99%
CAS号: 1905481-36-8 Compound CID : 119081409

分子式: C₁₅H₂₂N₄O₂ 分子量: 290.36

IUPAC Name: N-[(3R)-1-(5-propan-2-yl-1H-pyrazole-3-carbonyl)pyrrolidin-3-yl]cyclopropanecarboxamide

SMILES: CC(C)C1=CC(=NN1)C(=O)N2CCC(C2)NC(=O)C3CC3

InChIKey: CXEXTVGTDZRKJS-LLVKDONJSA-N

InChI: 1S/C15H22N4O2/c1-9(2)12-7-13(18-17-12)15(21)19-6-5-11(8-19)16-14(20)10-3-4-10/h7,9-11H,3-6,8H2,1-2H3,(H,16,20)(H,17,18)/t11-/m1/s1
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PIK-108
- ≥99%
CAS号: 901398-68-3 Compound CID : 70686584

分子式: C₂₂H₂₄N₂O₃ 分子量: 364.44

IUPAC Name: 8-(1-anilinoethyl)-6-methyl-2-morpholin-4-ylchromen-4-one

SMILES: CC1=CC2=C(C(=C1)C(C)NC3=CC=CC=C3)OC(=CC2=O)N4CCOCC4

InChIKey: VRCXIJAYLCUSHC-UHFFFAOYSA-N

InChI: 1S/C22H24N2O3/c1-15-12-18(16(2)23-17-6-4-3-5-7-17)22-19(13-15)20(25)14-21(27-22)24-8-10-26-11-9-24/h3-7,12-14,16,23H,8-11H2,1-2H3
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SAR-260301
- ≥99%
CAS号: 1260612-13-2 Compound CID : 135565159

分子式: C₁₉H₂₂N₄O₃ 分子量: 354.40

IUPAC Name: 2-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-4-morpholin-4-yl-1H-pyrimidin-6-one

SMILES: CC1CC2=CC=CC=C2N1C(=O)CC3=NC(=CC(=O)N3)N4CCOCC4

InChIKey: UAXHPOBBKRWJGA-ZDUSSCGKSA-N

InChI: 1S/C19H22N4O3/c1-13-10-14-4-2-3-5-15(14)23(13)19(25)11-16-20-17(12-18(24)21-16)22-6-8-26-9-7-22/h2-5,12-13H,6-11H2,1H3,(H,20,21,24)/t13-/m0/s1
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