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Drug Metabolite

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Items 25-36 of 425

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    Melamine
    Cas Number: 108-78-1        EC Number: 203-615-4
    Formula:  C3H6N6        Molecular Weight: 126.12
    IUPAC Name:  1,3,5-triazine-2,4,6-triamine
    SMILES:  C1(=NC(=NC(=N1)N)N)N
    InChIKey: JDSHMPZPIAZGSV-UHFFFAOYSA-N
    InChI:  InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)
    Synonyms: CCG-266105 | MELAMINE (IARC) | Melamine; 1,3,5-Triazine-2,4,6-triamine | STK378738 | 2,6-Triamino-1,3,5-triazine | s-...
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    N-Acetyl Sulfamethoxazole
      Grade & Purity: 
    • ≥98%
    Cas Number: 21312-10-7
    Formula:  C12H13N3O4S        Molecular Weight: 295.314
    IUPAC Name:  N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]acetamide
    SMILES:  CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
    InChIKey: GXPIUNZCALHVBA-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)
    Synonyms: N4-Acetylsulfamethoxazole, analytical standard | SULFAMETHOXAZOLE IMPURITY A [EP IMPURITY] | N-(4-(((5-Methylisoxazol...
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    N-Acetylprocainamide hydrochloride
      Grade & Purity: 
    • ≥98%(HPLC)
    Cas Number: 34118-92-8
    Formula:  C15H24ClN3O2        Molecular Weight: 313.82
    IUPAC Name:  4-acetamido-N-[2-(diethylamino)ethyl]benzamide;hydrochloride
    SMILES:  CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C.Cl
    InChIKey: IYEWBJUCJHKLHD-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H23N3O2.ClH/c1-4-18(5-2)11-10-16-15(20)13-6-8-14(9-7-13)17-12(3)19;/h6-9H,4-5,10-11H2,1-3H3,(H,16,20)(H,17,19);1H
    Synonyms: A20512 | Acecainide hydrochloride | NCGC00015072-10 | Tox21_500009 | Benzylpenicillin G | J-019456 | SCHEMBL122991 | ...
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    BTS 54-505 hydrochloride
      Grade & Purity: 
    • ≥99%
    Cas Number: 84484-78-6
    Formula:  C15H22NCl•HCl        Molecular Weight: 288.26
    IUPAC Name:  1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutan-1-amine;hydrochloride
    SMILES:  CC(C)CC(C1(CCC1)C2=CC=C(C=C2)Cl)N.Cl
    InChIKey: KHRVYINTXCWNRF-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H22ClN.ClH/c1-11(2)10-14(17)15(8-3-9-15)12-4-6-13(16)7-5-12;/h4-7,11,14H,3,8-10,17H2,1-2H3;1H
    Synonyms: EPA Pesticide Chemical Code 078802 | Esiteren | Q27293871 | Bts 54 505 | CYCLOBUTANEMETHANAMINE, 1-(4-CHLOROPHENYL)-....
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    Omeprazole Sulfide
      Grade & Purity: 
    • ≥98%(HPLC)(T)
    Cas Number: 73590-85-9
    Formula:  C17H19N3O2S        Molecular Weight: 329.42
    IUPAC Name:  6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]-1H-benzimidazole
    SMILES:  CC1=CN=C(C(=C1OC)C)CSC2=NC3=C(N2)C=C(C=C3)OC
    InChIKey: XURCIPRUUASYLR-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H19N3O2S/c1-10-8-18-15(11(2)16(10)22-4)9-23-17-19-13-6-5-12(21-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)
    Synonyms: CAS-73590-85-9 | INDIUMNITRATE | MFCD00869021 | 6-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)thio)-1H-ben...
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    N-desmethylclozapine
    Cas Number: 6104-71-8
    Formula:  C17H17ClN4        Molecular Weight: 312.8
    IUPAC Name:  3-chloro-6-piperazin-1-yl-11H-benzo[b][1,4]benzodiazepine
    SMILES:  C1CN(CCN1)C2=NC3=C(C=CC(=C3)Cl)NC4=CC=CC=C42
    InChIKey: JNNOSTQEZICQQP-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2
    Synonyms: BCP30683 | CAS_2820 | GTPL333 | UNII-1I9001LWY8 | BDBM50122054 | BRD-K10042277-001-04-3 | Desmethylclozapine | 3-chlo...
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    Pinostilbene
      Grade & Purity: 
    • ≥97%
    Cas Number: 42438-89-1        Compound CID:  5473050
    Formula:  C15H14O3        Molecular Weight: 242.27
    IUPAC Name:  3-[(E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol
    SMILES:  COC1=CC(=CC(=C1)O)C=CC2=CC=C(C=C2)O
    InChIKey: KUWZXOMQXYWKBS-NSCUHMNNSA-N
    InChI:  InChI=1S/C15H14O3/c1-18-15-9-12(8-14(17)10-15)3-2-11-4-6-13(16)7-5-11/h2-10,16-17H,1H3/b3-2+
    Synonyms: 3-[(1E)-2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol | 3-methoxy-4',5-dihydroxy-trans-stilbene | trans-Pinostilbene | ...
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    Urolithin A
      Grade & Purity: 
    • ≥98%(HPLC)
    Cas Number: 1143-70-0        Compound CID:  5488186
    Formula:  C13H8O4        Molecular Weight: 228.20
    IUPAC Name:  3,8-dihydroxybenzo[c]chromen-6-one
    SMILES:  C1=CC2=C(C=C1O)C(=O)OC3=C2C=CC(=C3)O
    InChIKey: RIUPLDUFZCXCHM-UHFFFAOYSA-N
    InChI:  InChI=1S/C13H8O4/c14-7-1-3-9-10-4-2-8(15)6-12(10)17-13(16)11(9)5-7/h1-6,14-15H
    Synonyms: 3,8-Dihydroxyurolithin | 3,8-dihydroxy-urolithin | FT-0778244 | 3,8-dihydroxy-6h-dibenzo[b,d]pyran-6-one | 3,8-Dihydr...
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    DL-3,4-Dihydroxymandelic Acid
    Cas Number: 775-01-9        Compound CID:  85782
    Formula:  C8H8O5        Molecular Weight: 184.15
    IUPAC Name:  2-(3,4-dihydroxyphenyl)-2-hydroxyacetic acid
    SMILES:  C1=CC(=C(C=C1C(C(=O)O)O)O)O
    InChIKey: RGHMISIYKIHAJW-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H8O5/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,9-11H,(H,12,13)
    Synonyms: CCRIS 3246 | UNII-EZI2C7VVU0 | Benzeneacetic acid, alpha,3,4-trihydroxy- | (3,4-Dihydroxyphenyl)glycolic acid | A8088...
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  10. , Serotonin 2a (5-HT2a) receptor antagonist
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    Paliperidone, Serotonin 2a (5-HT2a) receptor antagonist
    Cas Number: 144598-75-4
    Formula:  C23H27FN4O3        Molecular Weight: 426.48
    IUPAC Name:  3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
    SMILES:  CC1=C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
    InChIKey: PMXMIIMHBWHSKN-UHFFFAOYSA-N
    InChI:  InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,show more
    Synonyms: 9-hydroxy risperidone | N05AX13 | Q423292 | racemic paliperidone | RAC 9-HYDROXY RISPERIDONE | SR-02000000862 | FT-06...
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  11. , DNA cross-linking agent
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    Palifosfamide, DNA cross-linking agent
      Grade & Purity: 
    • ≥98%
    Cas Number: 31645-39-3
    Formula:  C4H11Cl2N2O2P        Molecular Weight: 221.02
    IUPAC Name:  bis(2-chloroethylamino)phosphinic acid
    SMILES:  C(CCl)NP(=O)(NCCCl)O
    InChIKey: BKCJZNIZRWYHBN-UHFFFAOYSA-N
    InChI:  InChI=1S/C4H11Cl2N2O2P/c5-1-3-7-11(9,10)8-4-2-6/h1-4H2,(H3,7,8,9,10)
    Synonyms: DB05668 | IPAM | 6A4U6NN813 | Isophosphoramide mustard | Isophosphamide mustard | N,N'-Di-(2-chloroethyl)phosphorodia...
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    Methyl all-cis-5,8,11,14,17-eicosapentaenoate
      Grade & Purity: 
    • ≥97%(GC)
    Cas Number: 2734-47-6
    Formula:  CH3(CH2CH=CH)5(CH2)3CO2CH3        Molecular Weight: 316.48
    IUPAC Name:  methyl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
    SMILES:  CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC
    InChIKey: QWDCYFDDFPWISL-JEBPEJKESA-N
    InChI:  InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-show more
    Synonyms: cis-5,8,11,14,17-Eicosapentaenoic acid methyl ester | 1H-1,2,4-Triazole, 1-((tert-butylcarbonyl-4-chlorophenoxy)methy...
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Molecule Type
  1. Small molecule 250 items
  2. Unknown 7 items
  3. Protein 1 item
Target
  1. HTR2A 7 items
  2. CHRM3 5 items
  3. CHRM1 5 items
  4. HTR2C 5 items
  5. HTR2B 5 items
  6. KCNH2 5 items
  7. SLC6A4 3 items
  8. CHRM5 3 items
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  10. CYP2D6 2 items
  11. DRD1 2 items
  12. DRD2 2 items
  13. DHFR 2 items
  14. DHODH 2 items
  15. HCAR2 2 items
  16. HRH1 2 items
  17. SLC6A2 2 items
  18. TAS2R39 2 items
  19. SHBG 2 items
  20. NAPRT 2 items
  21. PTGS1 2 items
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  23. CA1 2 items
  24. CA2 2 items
  25. CA12 2 items
  26. CA14 2 items
  27. CA9 2 items
  28. CA7 2 items
  29. HTR1B 2 items
  30. HTR4 2 items
  31. CHRM2 2 items
  32. ACE 2 items
  33. HTR7 2 items
  34. AGTR1 2 items
  35. HTR1D 2 items
  36. HTR1F 2 items
  37. HTR1A 2 items
  38. HTR6 2 items
  39. TAS2R14 2 items
  40. IMPDH2 2 items
  41. IMPDH1 2 items
  42. CYP1B1 1 item
  43. CYP2A6 1 item
  44. ESR1 1 item
  45. SLC22A12 1 item
  46. SRC 1 item
  47. VDR 1 item
  48. KCNJ6 1 item
  49. FDFT1 1 item
  50. KCNC1 1 item
  51. SLC6A3 1 item
  52. TOP1 1 item
  53. TRPA1 1 item
  54. PDE3A 1 item
  55. PDE3B 1 item
  56. MMP12 1 item
  57. CASP1 1 item
  58. CACNA1C 1 item
  59. CASP4 1 item
  60. CYP1A1 1 item
  61. ATP1A1 1 item
  62. DRD3 1 item
  63. GC 1 item
  64. XDH 1 item
  65. CHRNA7 1 item
  66. ABCG2 1 item
  67. ADRA2B 1 item
  68. ADRA2C 1 item
  69. ABL1 1 item
  70. HTR1E 1 item
  71. AKR1C3 1 item
  72. KCNK2 1 item
  73. KCNJ5 1 item
  74. KCNJ10 1 item
  75. NPC1L1 1 item
Physical Form
  1. Solid 24 items
  2. Liquid 2 items
Purity
  1. ≥98% 134 items
  2. ≥99% 52 items
  3. ≥97% 45 items
  4. ≥95% 40 items
  5. ≥98%(HPLC) 13 items
  6. ≥98%(GC) 5 items
  7. ≥90% 4 items
  8. ≥96% 3 items
  9. ≥97%(GC) 3 items
  10. ≥98%(CP),≥98 atom% D 2 items
  11. ≥98%(GC)(T) 2 items
  12. ≥98%(HPLC)(T) 2 items
  13. ≥98%(T) 2 items
  14. ≥80% 1 item
  15. ≥90%(HPLC) 1 item
  16. ≥94% 1 item
  17. ≥95 atom% D,≥95% 1 item
  18. ≥95%(T) 1 item
  19. ≥97%(HPLC) 1 item
  20. ≥98 atom% D,≥96%(CP) 1 item
  21. ≥98 atom% D,≥98% 1 item
  22. ≥98%(HPLC)(N) 1 item
  23. ≥98%(TLC) 1 item
  24. ≥99%(HPLC) 1 item
  25. ≥99%(HPLC)(T) 1 item
  26. ≥99.5% 1 item
  27. ≥99.5%(GC) 1 item
  28. ≥99.5%(HPLC) 1 item
  29. ≥99.6% 1 item
  30. ≥99.9%(HPLC) 1 item
Grade
  1. Moligand™ 49 items
  2. analytical standard 21 items
  3. AR 2 items
  4. for synthesis 2 items
  5. Melting point standard 1 item
  6. pharmaceutical grade 1 item
  7. PharmPure™ 1 item
  8. Standard for GC 1 item
  9. Standard for quantitative NMR 1 item
  10. Ultra pure 1 item
Action Type
  1. AGONIST 11 items
  2. INHIBITOR 11 items
  3. ANTAGONIST 6 items
  4. ALLOSTERIC MODULATOR 2 items
  5. CROSS-LINKING AGENT 2 items
  6. ACTIVATOR 1 item
  7. CHANNEL BLOCKER 1 item
  8. GATING INHIBITOR 1 item
Price
  1. $0.00 - $500.00 351 items
  2. $500.00 - $1,000.00 39 items
  3. $1,000.00 - $1,500.00 17 items
  4. $1,500.00 - $2,000.00 8 items
  5. $2,000.00 - $2,500.00 2 items
  6. $2,500.00 - $3,000.00 5 items
  7. $5,000.00 - $5,500.00 2 items
  8. $5,500.00 - $6,000.00 1 item
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