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MLS000097270,ZINC00936087,SMR000075802,5-allyl-8-[(4-methoxyphenyl)ami

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摘 要:MLS000097270,ZINC00936087,SMR000075802,5-allyl-8-[(4-methoxyphenyl)amino]-2,3-dimethylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one,Molecular Weight381.45146 [g/mol]Molecular FormulaC19H19N5O2SXLogP2.4H-Bond Donor1H-Bond Acceptor6Rotatable B
[Synonyms]
MLS000097270
ZINC00936087
SMR000075802
5-allyl-8-[(4-methoxyphenyl)amino]-2,3-dimethylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one

[Structure]
MLS000097270,ZINC00936087,SMR000075802,5-allyl-8-[(4-methoxyphenyl)ami

[ Properties Computed from Structure]
Molecular Weight381.45146 [g/mol]
Molecular FormulaC19H19N5O2S
XLogP2.4
H-Bond Donor1
H-Bond Acceptor6
Rotatable Bond Count5
Tautomer Count2
Exact Mass381.125946
MonoIsotopic Mass381.125946
Topological Polar Surface Area72.3
Heavy Atom Count27
Formal Charge0
Complexity570
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]

 
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