Ganetespib
3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-(1-methylindol-5-yl)-1H-1,2,4-triazol-5-one
Molecular Identity
Ganetespib
3-(2,4-dihydroxy-5-propan-2-ylphenyl)-4-(1-methylindol-5-yl)-1H-1,2,4-triazol-5-one
PubChem CID: 135564985
Ganetespib is a member of triazoles and a ring assembly.
2D Structure
Properties
C20H20N4O3
Molecular Formula
364.40
Molecular Weight
g/mol
364.1535
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
90.1
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
610
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)C1=C(C=C(C(=C1)C2=NNC(=O)N2C3=CC4=C(C=C3)N(C=C4)C)O)OIsomeric SMILES
SMILES: CC(C)C1=C(C=C(C(=C1)C2=NNC(=O)N2C3=CC4=C(C=C3)N(C=C4)C)O)OSynonyms(20)
Ganetespib888216-25-9STA-9090STA9090STA 90902E8412Y9463-[2,4-Dihydroxy-5-(propan-2-yl)phenyl]-4-(1-methyl-1H-indol-5-yl)-4,5-dihydro-1H-1,2,4-triazol-5-oneganetespibum3-(2,4-dihydroxy-5-(propan-2-yl)phenyl)-4-(1-methyl-1H-indol-5-yl)-4,5-dihydro-1H-1,2,4-triazol-5-oneRefChem:142390Hsp90 Inhibitor STA-90905-(2,4-dihydroxy-5-(1-methylethyl)phenyl)-2,4-dihydro-4-(1-methyl-1h-indol-5-yl)-3-(2,4-dihydroxy-5-isopropylphenyl)-4-(1-methylindol-5-yl)-5-hydroxy-4h-1,2,4-triazole 3h-1,2,4-triazol-3-oneGanetespib (STA-9090)5-[2,4-Dihydroxy-5-(1-methylethyl)phenyl]-2,4-dihydro-4-(1-methyl-1H-indol-5-yl)-3H-1,2,4-triazol-3-one
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Ganetespib
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