配体家族 - 小分子和化合物库

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TC-S 7003,Lck抑制剂
- ≥98%(HPLC)
CAS号: 847950-09-8 Compound CID : 11785878

分子式: C₃₁H₃₀N₈O 分子量: 530.62

IUPAC Name: 9-(2,6-dimethylphenyl)-4-[4-(4-methylpiperazin-1-yl)anilino]-1,3,5,9,11-pentazatetracyclo[8.7.0.02,7.012,17]heptadeca-2,4,6,10,12,14,16-heptaen-8-one

SMILES: CC1=C(C(=CC=C1)C)N2C(=O)C3=CN=C(N=C3N4C2=NC5=CC=CC=C54)NC6=CC=C(C=C6)N7CCN(CC7)C

InChIKey: BHJJWVDKNXABFS-UHFFFAOYSA-N

InChI: 1S/C31H30N8O/c1-20-7-6-8-21(2)27(20)39-29(40)24-19-32-30(35-28(24)38-26-10-5-4-9-25(26)34-31(38)39)33-22-11-13-23(14-12-22)37-17-15-36(3)16-18-37/h4-14,19H,15-18H2,1-3H3,(H,32,33,35)
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TAK 21d,FAAH抑制剂
- ≥98%(HPLC)
CAS号: 1143578-94-2 Compound CID : 57749996

分子式: C₁₉H₁₇F₂N₇O 分子量: 397.38

IUPAC Name: 4-[4-(3,4-difluorophenyl)pyrimidin-2-yl]-N-pyridazin-3-ylpiperazine-1-carboxamide

SMILES: C1CN(CCN1C2=NC=CC(=N2)C3=CC(=C(C=C3)F)F)C(=O)NC4=NN=CC=C4

InChIKey: JCWVFSJNIBAGQN-UHFFFAOYSA-N

InChI: 1S/C19H17F2N7O/c20-14-4-3-13(12-15(14)21)16-5-7-22-18(24-16)27-8-10-28(11-9-27)19(29)25-17-2-1-6-23-26-17/h1-7,12H,8-11H2,(H,25,26,29)
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SA 57,FAAH抑制剂
- ≥98%
CAS号: 1346169-63-8 Compound CID : 44589122

分子式: C₁₇H₂₃ClN₂O₃ 分子量: 338.83

IUPAC Name: [2-(methylamino)-2-oxoethyl] 4-[2-(4-chlorophenyl)ethyl]piperidine-1-carboxylate

SMILES: CNC(=O)COC(=O)N1CCC(CC1)CCC2=CC=C(C=C2)Cl

InChIKey: JFSSVCSHPDLFCM-UHFFFAOYSA-N

InChI: 1S/C17H23ClN2O3/c1-19-16(21)12-23-17(22)20-10-8-14(9-11-20)3-2-13-4-6-15(18)7-5-13/h4-7,14H,2-3,8-12H2,1H3,(H,19,21)
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PF 750,FAAH抑制剂
- ≥98%(HPLC)
CAS号: 959151-50-9 Compound CID : 25154868

分子式: C₂₂H₂₃N₃O 分子量: 345.44

IUPAC Name: N-phenyl-4-(quinolin-3-ylmethyl)piperidine-1-carboxamide

SMILES: C1CN(CCC1CC2=CC3=CC=CC=C3N=C2)C(=O)NC4=CC=CC=C4

InChIKey: BIODYGOZWZNCAG-UHFFFAOYSA-N

InChI: 1S/C22H23N3O/c26-22(24-20-7-2-1-3-8-20)25-12-10-17(11-13-25)14-18-15-19-6-4-5-9-21(19)23-16-18/h1-9,15-17H,10-14H2,(H,24,26)
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Ibrutinib (PCI-32765)
- 10mM in DMSO
CAS号: 936563-96-1

分子式: C₂₅H₂₄N₆O₂ 分子量: 440.5
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FAAH inhibitor 1
- 10mM in DMSO
CAS号: 326866-17-5 Compound CID : 1190414

分子式: C₂₄H₂₃N₃O₃S₃ 分子量: 497.65
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FAAH inhibitor 1
- ≥98%
CAS号: 326866-17-5 Compound CID : 1190414

分子式: C₂₄H₂₃N₃O₃S₃ 分子量: 497.65

IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

SMILES: CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4CCN(CC4)S(=O)(=O)C5=CC=CS5

InChIKey: IVGKSFUEBSXSAE-UHFFFAOYSA-N

InChI: 1S/C24H23N3O3S3/c1-16-4-9-20-21(15-16)32-24(26-20)18-5-7-19(8-6-18)25-23(28)17-10-12-27(13-11-17)33(29,30)22-3-2-14-31-22/h2-9,14-15,17H,10-13H2,1H3,(H,25,28)
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MAGL-IN-5
- ≥99%
CAS号: 359714-55-9 Compound CID : 9924775

分子式: C₁₈H₁₇N₃O₅ 分子量: 355.34

IUPAC Name: benzyl N-[4-(5-methoxy-2-oxo-1,3,4-oxadiazol-3-yl)-2-methylphenyl]carbamate

SMILES: CC1=C(C=CC(=C1)N2C(=O)OC(=N2)OC)NC(=O)OCC3=CC=CC=C3

InChIKey: QTENHWTVRQKWRI-UHFFFAOYSA-N

InChI: 1S/C18H17N3O5/c1-12-10-14(21-18(23)26-17(20-21)24-2)8-9-15(12)19-16(22)25-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,22)
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