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Technical details about Prestwick2_000893, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
Also known as: 4-biphenylacetic acid, 5728-52-9, 4-biphenylylacetic acid, Traxam, Dolinac, Biphenyl-4-ylacetic acid
Molecular Formula
C14H12O2
Molecular Weight
212.24  g/mol
InChI Key
QRZAKQDHEVVFRX-UHFFFAOYSA-N
FDA UNII
94WNJ5U8L7

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(4-phenylphenyl)acetic acid
2.1.2 InChI
InChI=1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16)
2.1.3 InChI Key
QRZAKQDHEVVFRX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O
2.2 Other Identifiers
2.2.1 UNII
94WNJ5U8L7
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 3-biphenylylacetic Acid

2. 4-biphenylylacetic Acid

3. Biphenylacetic Acid

4. Biphenylylacetic Acid

5. Biphenylylacetic Acid, 14c-labeled

6. Traxam

2.3.2 Depositor-Supplied Synonyms

1. 4-biphenylacetic Acid

2. 5728-52-9

3. 4-biphenylylacetic Acid

4. Traxam

5. Dolinac

6. Biphenyl-4-ylacetic Acid

7. Napageln

8. 4-carboxymethylbiphenyl

9. 2-(4-phenylphenyl)acetic Acid

10. P-biphenylylacetic Acid

11. [1,1'-biphenyl]-4-acetic Acid

12. P-biphenylacetic Acid

13. Seltouch

14. Biphenyl-4-acetic Acid

15. Ljc 10,141

16. Biphenyl-4-yl-acetic Acid

17. 4-biphenylaceticacid

18. Acetic Acid, (4-biphenylyl)-

19. Cl 83544

20. Ly 61017

21. (1,1'-biphenyl)-4-acetic Acid

22. L-141

23. Nsc 16284

24. 2-(biphenyl-4-yl)acetic Acid

25. 2-([1,1'-biphenyl]-4-yl)acetic Acid

26. 4-biphenyl Acetic Acid

27. Ljc-10141

28. Nsc-16284

29. Cl-83544

30. Cl 83,544

31. Mls000069466

32. 94wnj5u8l7

33. Chebi:31597

34. [1,1'-biphenyl]-4-ylacetic Acid

35. Ly-61017

36. Ncgc00016660-01

37. Smr000059071

38. Cas-5728-52-9

39. Dsstox_cid_25389

40. Dsstox_rid_80846

41. Dsstox_gsid_45389

42. Felbinacum [latin]

43. Felbinaco [spanish]

44. Felbinacum

45. Felbinaco

46. 2-{[1,1'-biphenyl]-4-yl}acetic Acid

47. Felbinac [usan:inn:ban:jan]

48. Einecs 227-233-2

49. Mfcd00004351

50. Brn 1211592

51. Unii-94wnj5u8l7

52. Dolonac

53. Flexfree

54. Ledergel

55. Napagel

56. Selspot

57. Sumilu

58. L 141

59. Zenol Exum

60. Felbinac (tn)

61. Bp4

62. Dolinac (tn)

63. Bpaa

64. Emec

65. Biphenyl-4acetic Acid

66. 4-biphenyl-acetic Acid

67. Felbinac [usan]

68. Opera_id_534

69. Felbinac [inn]

70. Felbinac [jan]

71. Felbinac [mi]

72. 4-biphenylyl Acetic Acid

73. 4-phenylphenylacetic Acid

74. Prestwick0_000893

75. Prestwick1_000893

76. Prestwick2_000893

77. Prestwick3_000893

78. (4'-biphenyl)acetic Acid

79. Felbinac [who-dd]

80. (biphenyl-4-yl)acetic Aci

81. (biphenyl-4-yl)acetic Acid

82. Oprea1_058748

83. Schembl26084

84. Bspbio_000706

85. 4-biphenylacetic Acid, 98%

86. Spbio_002915

87. 4-[l,l'biphenyl]ylacetic Acid

88. Bpbio1_000778

89. Chembl413965

90. Felbinac (jp17/usan/inn)

91. Zinc2318

92. Felbinac [ep Monograph]

93. Dtxsid0045389

94. 1,1'-biphenyl-4-ylacetic Acid

95. Hfn-310

96. Bdbm223312

97. Hms1570d08

98. Hms2097d08

99. Hms3714d08

100. Pharmakon1600-01506160

101. Bcp18699

102. Cs-d1194

103. Hy-b0641

104. Nsc16284

105. Tox21_110549

106. Ar1730

107. Nsc760372

108. S3685

109. Stk387569

110. Akos000119696

111. Tox21_110549_1

112. [1,1'-biphenyl]-4-ylacetic Acid #

113. Ac-8104

114. As-2883

115. Ccg-213621

116. Cs-8026

117. Db07477

118. Nsc-760372

119. Ncgc00016660-02

120. Ncgc00016660-03

121. Ncgc00016660-04

122. Ncgc00016660-06

123. Db-022648

124. Ab00384278

125. Ft-0602170

126. Ft-0617678

127. 28b529

128. B-2700

129. D01675

130. Ab00384278_14

131. Sr-01000003008

132. Q3742067

133. Sr-01000003008-2

134. Brd-k91740057-001-16-4

135. F2191-0076

136. Felbinac, European Pharmacopoeia (ep) Reference Standard

2.4 Create Date
2005-03-25
3 Chemical and Physical Properties
Molecular Weight 212.24 g/mol
Molecular Formula C14H12O2
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass212.083729621 g/mol
Monoisotopic Mass212.083729621 g/mol
Topological Polar Surface Area37.3 Ų
Heavy Atom Count16
Formal Charge0
Complexity223
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Inflammatory Agents, Non-Steroidal

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)


4.2 ATC Code

M02AA08

S76 | LUXPHARMA | Pharmaceuticals Marketed in Luxembourg | Pharmaceuticals marketed in Luxembourg, as published by d'Gesondheetskeess (CNS, la caisse nationale de sante, www.cns.lu), mapped by name to structures using CompTox by R. Singh et al. (in prep.). List downloaded from https://cns.public.lu/en/legislations/textes-coordonnes/liste-med-comm.html. Dataset DOI:10.5281/zenodo.4587355


M - Musculo-skeletal system

M02 - Topical products for joint and muscular pain

M02A - Topical products for joint and muscular pain

M02AA - Antiinflammatory preparations, non-steroids for topical use

M02AA08 - Felbinac


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