按“信号通路”分类 - 小分子和化合物库

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阿扎佩隆
- ≥99%
CAS号: 1649-18-9 EC号: 216-715-8

分子式: C₁₉H₂₂FN₃O 分子量: 327.4

IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one

SMILES: C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=N3

InChIKey: XTKDAFGWCDAMPY-UHFFFAOYSA-N

InChI: 1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2
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PF-3845,不可逆FAAH抑制剂
- ≥98%
CAS号: 1196109-52-0

分子式: C₂₄H₂₃F₃N₄O₂

IUPAC Name: N-pyridin-3-yl-4-[[3-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methyl]piperidine-1-carboxamide

SMILES: C1CN(CCC1CC2=CC(=CC=C2)OC3=NC=C(C=C3)C(F)(F)F)C(=O)NC4=CN=CC=C4

InChIKey: NBOJHRYUGLRASX-UHFFFAOYSA-N

InChI: 1S/C24H23F3N4O2/c25-24(26,27)19-6-7-22(29-15-19)33-21-5-1-3-18(14-21)13-17-8-11-31(12-9-17)23(32)30-20-4-2-10-28-16-20/h1-7,10,14-17H,8-9,11-13H2,(H,30,32)
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PF-04457845,不可逆FAAH抑制剂
- ≥98%
CAS号: 1020315-31-4

分子式: C₂₃H₂₀F₃N₅O₂ 分子量: 455.43

IUPAC Name: N-pyridazin-3-yl-4-[[3-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]piperidine-1-carboxamide

SMILES: C1CN(CCC1=CC2=CC(=CC=C2)OC3=NC=C(C=C3)C(F)(F)F)C(=O)NC4=NN=CC=C4

InChIKey: BATCTBJIJJEPHM-UHFFFAOYSA-N

InChI: 1S/C23H20F3N5O2/c24-23(25,26)18-6-7-21(27-15-18)33-19-4-1-3-17(14-19)13-16-8-11-31(12-9-16)22(32)29-20-5-2-10-28-30-20/h1-7,10,13-15H,8-9,11-12H2,(H,29,30,32)
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URB597,FAAH抑制剂
- ≥98%
CAS号: 546141-08-6 Compound CID : 1383884

分子式: C₂₀H₂₂N₂O₃ 分子量: 338.4

IUPAC Name: [3-(3-carbamoylphenyl)phenyl] N-cyclohexylcarbamate

SMILES: C1CCC(CC1)NC(=O)OC2=CC=CC(=C2)C3=CC(=CC=C3)C(=O)N

InChIKey: ROFVXGGUISEHAM-UHFFFAOYSA-N

InChI: 1S/C20H22N2O3/c21-19(23)16-8-4-6-14(12-16)15-7-5-11-18(13-15)25-20(24)22-17-9-2-1-3-10-17/h4-8,11-13,17H,1-3,9-10H2,(H2,21,23)(H,22,24)
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阿司咪唑
- ≥98%
CAS号: 68844-77-9 EC号: 272-441-9

分子式: C₂₈H₃₁FN₄O 分子量: 458.57

IUPAC Name: 1-[(4-fluorophenyl)methyl]-N-[1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl]benzimidazol-2-amine

SMILES: COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F

InChIKey: GXDALQBWZGODGZ-UHFFFAOYSA-N

InChI: 1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)
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度鲁特韦 (GSK1349572)
- ≥99%
CAS号: 1051375-16-6

分子式: C₂₀H₁₉F₂N₃O₅ 分子量: 419.38

IUPAC Name: (3S,7R)-N-[(2,4-difluorophenyl)methyl]-11-hydroxy-7-methyl-9,12-dioxo-4-oxa-1,8-diazatricyclo[8.4.0.03,8]tetradeca-10,13-diene-13-carboxamide

SMILES: CC1CCOC2N1C(=O)C3=C(C(=O)C(=CN3C2)C(=O)NCC4=C(C=C(C=C4)F)F)O

InChIKey: RHWKPHLQXYSBKR-BMIGLBTASA-N

InChI: 1S/C20H19F2N3O5/c1-10-4-5-30-15-9-24-8-13(17(26)18(27)16(24)20(29)25(10)15)19(28)23-7-11-2-3-12(21)6-14(11)22/h2-3,6,8,10,15,27H,4-5,7,9H2,1H3,(H,23,28)/t10-,15+/m1/s1
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氟哌啶醇
- ≥98%
CAS号: 52-86-8 EC号: 200-155-6

分子式: C₂₁H₂₃ClFNO₂ 分子量: 375.86

IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-fluorophenyl)butan-1-one

SMILES: C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(=O)C3=CC=C(C=C3)F

InChIKey: LNEPOXFFQSENCJ-UHFFFAOYSA-N

InChI: 1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2
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JNJ-1661010,FAAH抑制剂
- ≥98%
CAS号: 681136-29-8

分子式: C₁₉H₁₉N₅OS 分子量: 365.45

IUPAC Name: N-phenyl-4-(3-phenyl-1,2,4-thiadiazol-5-yl)piperazine-1-carboxamide

SMILES: C1CN(CCN1C2=NC(=NS2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChIKey: BHBOSTKQCZEAJM-UHFFFAOYSA-N

InChI: 1S/C19H19N5OS/c25-18(20-16-9-5-2-6-10-16)23-11-13-24(14-12-23)19-21-17(22-26-19)15-7-3-1-4-8-15/h1-10H,11-14H2,(H,20,25)
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LY2183240,花生四烯酸摄取抑制剂
- ≥98%
CAS号: 874902-19-9

分子式: C₁₇H₁₇N₅O 分子量: 307.35

IUPAC Name: N,N-dimethyl-5-[(4-phenylphenyl)methyl]tetrazole-1-carboxamide

SMILES: CN(C)C(=O)N1C(=NN=N1)CC2=CC=C(C=C2)C3=CC=CC=C3

InChIKey: GZNIYOXWFCDBBJ-UHFFFAOYSA-N

InChI: 1S/C17H17N5O/c1-21(2)17(23)22-16(18-19-20-22)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
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1,3-二邻甲苯基胍
- ≥99%
CAS号: 97-39-2 EC号: 202-577-6

分子式: C₁₅H₁₇N₃ 分子量: 239.32

IUPAC Name: 1,2-bis(2-methylphenyl)guanidine

SMILES: CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N

InChIKey: OPNUROKCUBTKLF-UHFFFAOYSA-N

InChI: 1S/C15H17N3/c1-11-7-3-5-9-13(11)17-15(16)18-14-10-6-4-8-12(14)2/h3-10H,1-2H3,(H3,16,17,18)
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氯喹
- ≥97%
CAS号: 54-05-7 EC号: 200-191-2

分子式: C₁₈H₂₆ClN₃ 分子量: 319.87

IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine

SMILES: CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl

InChIKey: WHTVZRBIWZFKQO-UHFFFAOYSA-N

InChI: 1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
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AACOCF3（花生四烯酸三氟甲基酮）
- ≥98%
- 10 mg/mL in ethanol
CAS号: 149301-79-1

分子式: C₂₁H₃₁F₃O 分子量: 356.47

IUPAC Name: (6Z,9Z,12Z,15Z)-1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one

SMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)C(F)(F)F

InChIKey: PLWROONZUDKYKG-DOFZRALJSA-N

InChI: 1S/C21H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(25)21(22,23)24/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3/b7-6-,10-9-,13-12-,16-15-
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