配体家族 - 小分子和化合物库

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吗氯贝胺
- ≥98%
CAS号: 71320-77-9 EC号: MFCD00865388

分子式: C₁₃H₁₇ClN₂O₂ 分子量: 268.74

IUPAC Name: 4-chloro-N-(2-morpholin-4-ylethyl)benzamide

SMILES: C1COCCN1CCNC(=O)C2=CC=C(C=C2)Cl

InChIKey: YHXISWVBGDMDLQ-UHFFFAOYSA-N

InChI: 1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
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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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甲磺酸雷沙吉兰
- ≥99%
CAS号: 161735-79-1 Compound CID : 3052775

分子式: C₁₂H₁₃N·CH₄O₃S 分子量: 267.34

IUPAC Name: methanesulfonic acid;(1R)-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine

SMILES: CS(=O)(=O)O.C#CCNC1CCC2=CC=CC=C12

InChIKey: JDBJJCWRXSVHOQ-UTONKHPSSA-N

InChI: 1S/C12H13N.CH4O3S/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12;1-5(2,3)4/h1,3-6,12-13H,7-9H2;1H3,(H,2,3,4)/t12-;/m1./s1
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(R)-(-)-丙炔苯丙胺盐酸盐
- ≥98%(HPLC)
CAS号: 14611-52-0

分子式: C₁₃H₁₇N · HCl 分子量: 223.74

IUPAC Name: (2R)-N-methyl-1-phenyl-N-prop-2-ynylpropan-2-amine;hydrochloride

SMILES: CC(CC1=CC=CC=C1)N(C)CC#C.Cl

InChIKey: IYETZZCWLLUHIJ-UTONKHPSSA-N

InChI: 1S/C13H17N.ClH/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13;/h1,5-9,12H,10-11H2,2-3H3;1H/t12-;/m1./s1
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Raf inhibitor 1
- 10mM in DMSO
CAS号: 1093100-40-3 Compound CID : 44223999

分子式: C₂₆H₁₉ClN₈ 分子量: 478.9
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Raxatrigine hydrochloride
- 10mM in DMSO
CAS号: 934240-31-0 Compound CID : 16046067

分子式: C₁₈H₂₀ClFN₂O₂ 分子量: 350.8
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Sutezolid
- ≥99%
CAS号: 168828-58-8 Compound CID : 465951

分子式: C₁₆H₂₀FN₃O₃S 分子量: 353.41

IUPAC Name: N-[[(5S)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

SMILES: CC(=O)NCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCSCC3)F

InChIKey: FNDDDNOJWPQCBZ-ZDUSSCGKSA-N

InChI: 1S/C16H20FN3O3S/c1-11(21)18-9-13-10-20(16(22)23-13)12-2-3-15(14(17)8-12)19-4-6-24-7-5-19/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,21)/t13-/m0/s1
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BI-882370
- ≥99%
CAS号: 1392429-79-6 Compound CID : 60152613

分子式: C₂₈H₃₃F₂N₇O₂S 分子量: 569.67

IUPAC Name: N-[3-[5-[(1-ethylpiperidin-4-yl)-methylamino]-3-pyrimidin-5-ylpyrrolo[3,2-b]pyridin-1-yl]-2,4-difluorophenyl]propane-1-sulfonamide

SMILES: CCCS(=O)(=O)NC1=C(C(=C(C=C1)F)N2C=C(C3=C2C=CC(=N3)N(C)C4CCN(CC4)CC)C5=CN=CN=C5)F

InChIKey: AEJACXAFHXBVHF-UHFFFAOYSA-N

InChI: 1S/C28H33F2N7O2S/c1-4-14-40(38,39)34-23-7-6-22(29)28(26(23)30)37-17-21(19-15-31-18-32-16-19)27-24(37)8-9-25(33-27)35(3)20-10-12-36(5-2)13-11-20/h6-9,15-18,20,34H,4-5,10-14H2,1-3H3
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Raxatrigine hydrochloride
- ≥99%
CAS号: 934240-31-0 Compound CID : 16046067

分子式: C₁₈H₂₀ClFN₂O₂ 分子量: 350.8

IUPAC Name: (2S,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide;hydrochloride

SMILES: C1CC(NC1C2=CC=C(C=C2)OCC3=CC=CC=C3F)C(=O)N.Cl

InChIKey: HEPUBAGOKRIZEO-PPPUBMIESA-N

InChI: 1S/C18H19FN2O2.ClH/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22;/h1-8,16-17,21H,9-11H2,(H2,20,22);1H/t16-,17+;/m1./s1
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Raf inhibitor 1
- ≥98%
CAS号: 1093100-40-3 Compound CID : 44223999

分子式: C₂₆H₁₉ClN₈ 分子量: 478.9

IUPAC Name: 1-N-(4-chlorophenyl)-6-methyl-5-N-[3-(7H-purin-6-yl)pyridin-2-yl]isoquinoline-1,5-diamine

SMILES: CC1=C(C2=C(C=C1)C(=NC=C2)NC3=CC=C(C=C3)Cl)NC4=C(C=CC=N4)C5=C6C(=NC=N5)N=CN6

InChIKey: KKVYYGGCHJGEFJ-UHFFFAOYSA-N

InChI: 1S/C26H19ClN8/c1-15-4-9-19-18(10-12-29-24(19)34-17-7-5-16(27)6-8-17)21(15)35-25-20(3-2-11-28-25)22-23-26(32-13-30-22)33-14-31-23/h2-14H,1H3,(H,28,35)(H,29,34)(H,30,31,32,33)
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