配体家族 - 小分子和化合物库

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罗美昔布
- ≥98%
CAS号: 220991-20-8

分子式: C₁₅H₁₃ClFNO₂ 分子量: 293.72

IUPAC Name: 2-[2-(2-chloro-6-fluoroanilino)-5-methylphenyl]acetic acid

SMILES: CC1=CC(=C(C=C1)NC2=C(C=CC=C2Cl)F)CC(=O)O

InChIKey: KHPKQFYUPIUARC-UHFFFAOYSA-N

InChI: 1S/C15H13ClFNO2/c1-9-5-6-13(10(7-9)8-14(19)20)18-15-11(16)3-2-4-12(15)17/h2-7,18H,8H2,1H3,(H,19,20)
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舒洛芬
- ≥99%
CAS号: 40828-46-4 Compound CID : 5359

分子式: C₁₄H₁₂O₃S 分子量: 260.31

IUPAC Name: 2-[4-(thiophene-2-carbonyl)phenyl]propanoic acid

SMILES: CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)O

InChIKey: MDKGKXOCJGEUJW-UHFFFAOYSA-N

InChI: 1S/C14H12O3S/c1-9(14(16)17)10-4-6-11(7-5-10)13(15)12-3-2-8-18-12/h2-9H,1H3,(H,16,17)
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依托考昔
- ≥98%
CAS号: 202409-33-4

分子式: C₁₈H₁₅ClN₂O₂S 分子量: 358.84

IUPAC Name: 5-chloro-2-(6-methylpyridin-3-yl)-3-(4-methylsulfonylphenyl)pyridine

SMILES: CC1=NC=C(C=C1)C2=C(C=C(C=N2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChIKey: MNJVRJDLRVPLFE-UHFFFAOYSA-N

InChI: 1S/C18H15ClN2O2S/c1-12-3-4-14(10-20-12)18-17(9-15(19)11-21-18)13-5-7-16(8-6-13)24(2,22)23/h3-11H,1-2H3
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依托度酸
- ≥98%
CAS号: 41340-25-4

分子式: C₁₇H₂₁NO₃ 分子量: 287.35

IUPAC Name: 2-(1,8-diethyl-4,9-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid

SMILES: CCC1=C2C(=CC=C1)C3=C(N2)C(OCC3)(CC)CC(=O)O

InChIKey: NNYBQONXHNTVIJ-UHFFFAOYSA-N

InChI: 1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)
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卡洛芬
- ≥98%(HPLC)
CAS号: 53716-49-7

分子式: C₁₅H₁₂ClNO₂ 分子量: 273.72

IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acid

SMILES: CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)O

InChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-N

InChI: 1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
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2-(2,6-二氯苯氨基)苯乙酸
- ≥98%
CAS号: 15307-86-5

分子式: C₁₄H₁₁Cl₂NO₂ 分子量: 296.15

IUPAC Name: 2-[2-(2,6-dichloroanilino)phenyl]acetic acid

SMILES: C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl

InChIKey: DCOPUUMXTXDBNB-UHFFFAOYSA-N

InChI: 1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
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酮咯酸
- ≥98%
CAS号: 74103-06-3

分子式: C₁₅H₁₃NO₃ 分子量: 255.27

IUPAC Name: 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

SMILES: C1CN2C(=CC=C2C(=O)C3=CC=CC=C3)C1C(=O)O

InChIKey: OZWKMVRBQXNZKK-UHFFFAOYSA-N

InChI: 1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)
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NS 398,COX-2抑制剂
- ≥98%
CAS号: 123653-11-2

分子式: C₁₃H₁₈N₂O₅S 分子量: 314.36

IUPAC Name: N-(2-cyclohexyloxy-4-nitrophenyl)methanesulfonamide

SMILES: CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2CCCCC2

InChIKey: KTDZCOWXCWUPEO-UHFFFAOYSA-N

InChI: 1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
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甲氯芬那酸
- ≥98%
CAS号: 644-62-2

分子式: C₁₄H₁₁Cl₂NO₂ 分子量: 296.15

IUPAC Name: 2-(2,6-dichloro-3-methylanilino)benzoic acid

SMILES: CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)O)Cl

InChIKey: SBDNJUWAMKYJOX-UHFFFAOYSA-N

InChI: 1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)
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氟灭酸
- ≥99%
CAS号: 530-78-9

分子式: C₁₄H₁₀F₃NO₂ 分子量: 281.23

IUPAC Name: 2-[3-(trifluoromethyl)anilino]benzoic acid

SMILES: C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F

InChIKey: LPEPZBJOKDYZAD-UHFFFAOYSA-N

InChI: 1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)
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卡洛芬
- 10mM in DMSO
CAS号: 53716-49-7

分子式: C₁₅H₁₂ClNO₂ 分子量: 273.72

IUPAC Name: 2-(6-chloro-9H-carbazol-2-yl)propanoic acid

SMILES: CC(C1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl)C(=O)O

InChIKey: PUXBGTOOZJQSKH-UHFFFAOYSA-N

InChI: 1S/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
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(S)-(+)-2-(6-甲氧基-2-萘基)丙酸
- 10mM in DMSO
CAS号: 22204-53-1

分子式: C₁₄H₁₄O₃ 分子量: 230.26

IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid

SMILES: CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O

InChIKey: CMWTZPSULFXXJA-VIFPVBQESA-N

InChI: 1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
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