Lanifibranor
4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloroindol-2-yl]butanoic acid
Molecular Identity
Lanifibranor
4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloroindol-2-yl]butanoic acid
PubChem CID: 68677842
2D Structure
Properties
C19H15ClN2O4S2
Molecular Formula
434.90
Molecular Weight
g/mol
434.0162
Exact Mass
Da
4.5
XLogP
Drug-like (Lipinski: < 5)
126
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
686
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC2=C(C=C1S(=O)(=O)N3C4=C(C=C(C=C4)Cl)C=C3CCCC(=O)O)SC=N2Isomeric SMILES
SMILES: C1=CC2=C(C=C1S(=O)(=O)N3C4=C(C=C(C=C4)Cl)C=C3CCCC(=O)O)SC=N2Synonyms(20)
Lanifibranor927961-18-0IVA-337IVA33728Q8AG0PYL1H-Indole-2-butanoic acid, 1-(6-benzothiazolylsulfonyl)-5-chloro-5-chloro-1-[(6-benzothiazolyl)sulfonyl]-1h-indole-2-butanoic acid5-Chloro-1-((6-benzothiazolyl)sulfonyl)-1H-indole-2-butanoic acid4-[1-(1,3-benzothiazol-6-ylsulfonyl)-5-chloro-indol-2-yl]butanoic acid4-(1-(1,3-Benzothiazol-6-ylsulfonyl)-5-chloro-indol-2-yl)butanoic acid4-[1-(1,3-benzothiazole-6-sulfonyl)-5-chloro-1H-indol-2-yl]butanoic acidlanifibranorum4-(1-(1,3-benzothiazole-6-sulfonyl)-5-chloro-1H-indol-2-yl)butanoic acidRefChem:152253Lanifibranor (IVA-337)
Data from PubChem (NCBI)
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Drug Network
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