7-hydroxydichloromethotrexate
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7-hydroxydichloromethotrexate
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CAS No:
751-75-7
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Formula:
C20H20Cl2N8O6
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Chemical Name:
7-hydroxydichloromethotrexate
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Synonyms:
7-HDCM;7-hydroxydichloromethotrexate;(3,5-dichloro-4-(((2,4-diamino-7-oxo-1,7-dihydropteridin-6-yl)methyl)(methyl)amino)benzoyl)-L-glutamic acid;DTXSID50226071;L-Glutamic acid, N-(3,5-dichloro-4-(((2,4-diamino-1,7-dihydro-7-oxo-6-pteridinyl)methyl)methylamino)benzoyl)-
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CAS No:
Computed Properties
Molecular Weight:539.3
XLogP3:0.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:9
Exact Mass:538.0882858
Monoisotopic Mass:538.0882858
Topological Polar Surface Area:226
Heavy Atom Count:36
Complexity:897
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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