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  1. GR 144053 trihydrochloride
    CAS: 1215333-48-4 PubChem CID: 16759148 Formula: C18H30Cl3N5O2 Molecular Weight: 454.83
    In Stock Item #: G288867
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    IUPAC Name
    2-[4-[4-(4-carbamimidoylphenyl)piperazin-1-yl]piperidin-1-yl]acetic acid;trihydrochloride
    SMILES
    C1CN(CCC1N2CCN(CC2)C3=CC=C(C=C3)C(=N)N)CC(=O)O.Cl.Cl.Cl
    InChIKey
    YKRNPHOBDOUQTG-UHFFFAOYSA-N
    InChI
    1S/C18H27N5O2.3ClH/c19-18(20)14-1-3-15(4-2-14)22-9-11-23(12-10-22)16-5-7-21(8-6-16)13-17(24)25;;;/h1-4,16H,5-13H2,(H3,19,20)(H,24,25);3*1H
    Synonyms
    4-[4-[4-(Aminoiminomethyl)phenyl]-1-piperazinyl]-1-piperidineacetic acid trihydrochloride | 2-(4-(4-(4-carbamimidoylp...
  2. Lifitegrast, Integrin alpha-L/beta-2 (LFA-1) antagonist
    CAS: 1025967-78-5 EC Number: 813-044-8 Formula: C29H24Cl2N2O7S Molecular Weight: 615.48
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    In Stock Item #: L171714
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    IUPAC Name
    (2S)-2-[[2-(1-benzofuran-6-carbonyl)-5,7-dichloro-3,4-dihydro-1H-isoquinoline-6-carbonyl]amino]-3-(3-methylsulfonylphenyl)propanoic acid
    SMILES
    CS(=O)(=O)C1=CC=CC(=C1)CC(C(=O)O)NC(=O)C2=C(C=C3CN(CCC3=C2Cl)C(=O)C4=CC5=C(C=C4)C=CO5)Cl
    InChIKey
    JFOZKMSJYSPYLN-QHCPKHFHSA-N
    InChI
    1S/C29H24Cl2N2O7S/c1-41(38,39)20-4-2-3-16(11-20)12-23(29(36)37)32-27(34)25-22(30)13-19-15-33(9-7-21(19)26(25)31)28(35)18-6-5-17-8-10-40-24(17)14-18/h2show more
    Synonyms
    EN300-20605731 | 7-hydroxy-2-methyl-3-phenoxy-chromone | s3714 | A900838 | Q23044263 | N-(2-(1-benzofuran-6-carbonyl)...
  3. Leukadherin-1
    CAS: 344897-95-6 Formula: C22H15NO4S2 Molecular Weight: 421.49
    In Stock Item #: L275488
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    IUPAC Name
    4-[5-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid
    SMILES
    C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)SC2=S
    InChIKey
    AEZGRQSLKVNPCI-UNOMPAQXSA-N
    InChI
    1S/C22H15NO4S2/c24-20-19(29-22(28)23(20)13-14-4-2-1-3-5-14)12-17-10-11-18(27-17)15-6-8-16(9-7-15)21(25)26/h1-12H,13H2,(H,25,26)/b19-12-
    Synonyms
    Leukadherin 1 | SCHEMBL18301010 | HY-15701 | (Z)-4-(5-((3-benzyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)furan-2-y...
  4. Gly-Arg-Gly-Asp-Ser TFA
    CAS: 96426-21-0(free base) Formula: C17H30N8O9·xC2HF3O2 Molecular Weight: 490.47(free base)
    In Stock Item #: G305036
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    Synonyms
    L-Serine, N-(N-(N-(N2-glycyl-L-arginyl)glycyl)-L-alpha-aspartyl)- | Gly-Arg-Gly-Asp-Ser, >=97% (HPLC) | NH2-Gly-Arg-G...
  5. BIO 5192
    CAS: 327613-57-0 Formula: C38H46Cl2N6O8S Molecular Weight: 817.78
    Out of Stock Item #: B286648
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    IUPAC Name
    (2S)-2-[[(2S)-1-(3,5-dichlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-4-[[(2S)-4-methyl-2-[methyl-[2-[4-[(2-methylphenyl)carbamoylamino]phenyl]aceshow more
    SMILES
    CC1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)CC(=O)N(C)C(CC(C)C)C(=O)NCCC(C(=O)O)NC(=O)C3CCCN3S(=O)(=O)C4=CC(=CC(=C4)Cl)Cl
    InChIKey
    MNQBPRHHZPXCKZ-ZDCRTTOTSA-N
    InChI
    1S/C38H46Cl2N6O8S/c1-23(2)18-33(45(4)34(47)19-25-11-13-28(14-12-25)42-38(52)44-30-9-6-5-8-24(30)3)35(48)41-16-15-31(37(50)51)43-36(49)32-10-7-17-46(32show more
    Synonyms
    (2S)-2-[[[(2S)-1-[(3,5-Dichlorophenyl)sulfonyl]-2-pyrrolidinyl]carbonyl]amino]-4-[[(2S)-4-methyl-2-[methyl[2-[4-[[[(2...
  6. BIRT 377, Inhibitor of integrin; alpha L subunit (antigen CD11A (p180); lymphocyte function-associated antigen 1; alpha polypeptide)
    CAS: 213211-10-0 Formula: C18H15BrCl2N2O2 Molecular Weight: 442.13
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(HPLC)
    Out of Stock Item #: B287562
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    IUPAC Name
    (5R)-5-[(4-bromophenyl)methyl]-3-(3,5-dichlorophenyl)-1,5-dimethylimidazolidine-2,4-dione
    SMILES
    CC1(C(=O)N(C(=O)N1C)C2=CC(=CC(=C2)Cl)Cl)CC3=CC=C(C=C3)Br
    InChIKey
    FJNJHZQMQRVZEE-GOSISDBHSA-N
    InChI
    1S/C18H15BrCl2N2O2/c1-18(10-11-3-5-12(19)6-4-11)16(24)23(17(25)22(18)2)15-8-13(20)7-14(21)9-15/h3-9H,10H2,1-2H3/t18-/m1/s1
    Synonyms
    (5R)-5-[(4-Bromophenyl)methyl]-3-(3,5-dichlorophenyl)-1,5-dimethyl-2,4-imidazolidinedione
  7. A 286982, Inhibitor of integrin αLβ2
    CAS: 280749-17-9 Formula: C24H27N3O4S Molecular Weight: 453.55
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: A288284
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    IUPAC Name
    (E)-1-(4-acetylpiperazin-1-yl)-3-[3-nitro-4-(2-propan-2-ylphenyl)sulfanylphenyl]prop-2-en-1-one
    SMILES
    CC(C)C1=CC=CC=C1SC2=C(C=C(C=C2)C=CC(=O)N3CCN(CC3)C(=O)C)[N+](=O)[O-]
    InChIKey
    HTGGAYLWTDOFDK-PKNBQFBNSA-N
    InChI
    1S/C24H27N3O4S/c1-17(2)20-6-4-5-7-22(20)32-23-10-8-19(16-21(23)27(30)31)9-11-24(29)26-14-12-25(13-15-26)18(3)28/h4-11,16-17H,12-15H2,1-3H3/b11-9+
    Synonyms
    A286982 | A899560 | UNII-5I8WFS075A | BDBM50092956 | F77491 | A 286,982 | (2E)-1-(4-Acetyl-1-piperazinyl)-3-[4-[[2-(1...
  8. Arg-Gly-Asp-Ser
    CAS: 91037-65-9 Formula: C15H27N7O8 Molecular Weight: 433.42
    In Stock Item #: A101721
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    IUPAC Name
    (3S)-3-[[2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-[[(1S)-1-carboxy-2-hydroxyethyl]amino]-4-oxobutanoic acid
    SMILES
    C(CC(C(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(CO)C(=O)O)N)CN=C(N)N
    InChIKey
    NNRFRJQMBSBXGO-CIUDSAMLSA-N
    InChI
    1S/C15H27N7O8/c16-7(2-1-3-19-15(17)18)12(27)20-5-10(24)21-8(4-11(25)26)13(28)22-9(6-23)14(29)30/h7-9,23H,1-6,16H2,(H,20,27)(H,21,24)(H,22,28)(H,25,26)show more
    Synonyms
    RGDS | (S)-3-[2-((S)-2-Amino-5-guanidino-pentanoylamino)-acetylamino]-N-((R)-1-carboxy-2-hydroxy-ethyl)-succinamic ac...
  9. Eptifibatide acetate
    CAS: 881997-86-0 PubChem CID: 12001375 Formula: C35H49N11O9S2·xC2H4O2 Molecular Weight: 831.96 (free base basis)
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: E339599
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    IUPAC Name
    acetic acid;2-[(3S,6S,12S,20R,23S)-20-carbamoyl-12-[4-(diaminomethylideneamino)butyl]-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,22-hexaoxo-17,18-dithia-1,4,show more
    SMILES
    CC(=O)O.C1CC2C(=O)NC(CSSCCC(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)N2C1)CC3=CNC4=CC=CC=C43)CC(=O)O)CCCCN=C(N)N)C(=O)N
    InChIKey
    KWKBRYJYRIUYEI-QMYFOHRPSA-N
    InChI
    1S/C35H49N11O9S2.C2H4O2/c36-30(51)25-18-57-56-13-10-27(47)42-22(8-3-4-11-39-35(37)38)31(52)41-17-28(48)43-23(15-29(49)50)32(53)44-24(14-19-16-40-21-7-show more
    Synonyms
    acetic acid;2-[(3S,6S,12S,20R,23S)-20-carbamoyl-12-[4-(diaminomethylideneamino)butyl]-3-(1H-indol-3-ylmethyl)-2,5,8,1...
  10. Surfactin(mixture of isomers)
    CAS: 252023-70-4 EC Number: 607-428-2 Formula: Molecular Weight: 1025.04(Average)
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95% mixture of isomers
    In Stock Item #: S329585
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    IUPAC Name
    3-[(3S,6R,9S,12S,15R,18S,21S,25R)-9-(carboxymethyl)-3,6,15,18-tetrakis(2-methylpropyl)-25-(10-methylundecyl)-2,5,8,11,14,17,20,23-octaoxo-12-propan-2-show more
    SMILES
    CC(C)CCCCCCCCCC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O1)CC(C)C)CC(C)C)CC(=O)O)C(C)C)CC(C)C)CC(C)C)CCC(=O)O
    InChIKey
    NJGWOFRZMQRKHT-WGVNQGGSSA-N
    InChI
    1S/C53H93N7O13/c1-30(2)20-18-16-14-13-15-17-19-21-36-28-43(61)54-37(22-23-44(62)63)47(66)55-38(24-31(3)4)48(67)57-40(26-33(7)8)51(70)60-46(35(11)12)52show more
    Synonyms
    surfactin C | 3-[(3S,6R,9S,12S,15R,18S,21S,25R)-9-(carboxymethyl)-3,6,15,18-tetrakis(2-methylpropyl)-25-(10-methylund...
  11. Zaurategrast, Inhibitor of integrin α4β1;Inhibitor of integrin α4β7;Inhibitor of integrin; alpha 4 subunit (antigen CD49D; alpha 4 subunit of VLA-4 receptor)
    CAS: 455264-31-0 PubChem CID: 10186367 Formula: C26H25BrN4O3 Molecular Weight: 521.42
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    Out of Stock Item #: Z126002
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    IUPAC Name
    (2S)-2-[(2-bromo-3-oxospiro[3.5]non-1-en-1-yl)amino]-3-[4-(2,7-naphthyridin-1-ylamino)phenyl]propanoic acid
    SMILES
    C1CCC2(CC1)C(=C(C2=O)Br)NC(CC3=CC=C(C=C3)NC4=NC=CC5=C4C=NC=C5)C(=O)O
    InChIKey
    KYHVWHYLKOHLKA-FQEVSTJZSA-N
    InChI
    1S/C26H25BrN4O3/c27-21-22(26(23(21)32)10-2-1-3-11-26)31-20(25(33)34)14-16-4-6-18(7-5-16)30-24-19-15-28-12-8-17(19)9-13-29-24/h4-9,12-13,15,20,31H,1-3,show more
    Synonyms
    HY-70073 | AKOS016005046 | NCGC00378753-01 | DTXSID90196547 | Zaurategrast | CT7758 | CT-7758 | ZAURATEGRAST [WHO-DD]...
  12. A-205804
    CAS: 251992-66-2 Formula: C15H12N2OS2 Molecular Weight: 300.39
    In Stock Item #: A129416
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    IUPAC Name
    4-(4-methylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxamide
    SMILES
    CC1=CC=C(C=C1)SC2=C3C=C(SC3=CN=C2)C(=O)N
    InChIKey
    QQGWEXFLMJGCAL-UHFFFAOYSA-N
    InChI
    1S/C15H12N2OS2/c1-9-2-4-10(5-3-9)19-13-7-17-8-14-11(13)6-12(20-14)15(16)18/h2-8H,1H3,(H2,16,18)
    Synonyms
    1-Des-arg-bradykinin | NCGC00167761-01 | J-015866 | MFCD09038566 | Q27195214 | 4-(p-tolylthio)thieno[2,3-c]pyridine-2...
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