API0233050
Tepotinib Hydrochloride
Tenofovir Alafenamide Fumarate and Tenofovir Disoproxil Fumarate are nucleoside reverse transcriptase inhibitors used for HIV and hepatitis B.
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CAS No.
1946826-82-9
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Synonyms
Tepotinib hydrochloride; 1946826-82-9; Tepmetko
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CHEMBL ID
CHEMBL4594292
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Molecule Type
Small molecule
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Compound CID
46700774
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Molecular Weight (g/mol)
547
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Molecular Formula
C29H31ClN6O3
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InChI
InChI=1S/C29H28N6O2.ClH.H2O/c1-34-12-10-21(11-13-34)20-37-26-17-31-29(32-18-26)25-7-3-5-23(15-25)19-35-28(36)9-8-27(33-35)24-6-2-4-22(14-24)16-30;;/h2-9,14-15,17-18,21H,10-13,19-20H2,1H3;1H;1H2
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InChIKey
KZVOMLRKFJUTLK-UHFFFAOYSA-N
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SMILES
CN1CCC(CC1)COC2=CN=C(N=C2)C3=CC=CC(=C3)CN4C(=O)C=CC(=N4)C5=CC=CC(=C5)C#N.O.Cl
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IUPAC Name
3-[1-[[3-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]phenyl]methyl]-6-oxopyridazin-3-yl]benzonitrile;hydrate;hydrochloride
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Exact Mass (Da)
546.2146166
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Monoisotopic Mass (Da)
546.2146166
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