
API0232543
Entrectinib
Entecavir is an antiviral drug (for hepatitis B).
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CAS No.
1108743-60-7
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Synonyms
Entrectinib; 1108743-60-7; Rozlytrek
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CHEMBL ID
CHEMBL1983268
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Indications
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Molecule Type
Small molecule
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Compound CID
25141092
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Molecular Weight (g/mol)
560.6
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Molecular Formula
C31H34F2N6O2
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InChI
InChI=1S/C31H34F2N6O2/c1-38-8-10-39(11-9-38)25-3-4-26(29(19-25)34-24-6-12-41-13-7-24)31(40)35-30-27-17-20(2-5-28(27)36-37-30)14-21-15-22(32)18-23(33)16-21/h2-5,15-19,24,34H,6-14H2,1H3,(H2,35,36,37,40)
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InChIKey
HAYYBYPASCDWEQ-UHFFFAOYSA-N
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SMILES
CN1CCN(CC1)C2=CC(=C(C=C2)C(=O)NC3=NNC4=C3C=C(C=C4)CC5=CC(=CC(=C5)F)F)NC6CCOCC6
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IUPAC Name
N-[5-[(3,5-difluorophenyl)methyl]-1H-indazol-3-yl]-4-(4-methylpiperazin-1-yl)-2-(oxan-4-ylamino)benzamide
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Exact Mass (Da)
560.27113067
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Monoisotopic Mass (Da)
560.27113067
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