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MLS000081591,STOCK4S-09181,BAS 12457939,SMR000043310,Molecular Weight4

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摘 要:MLS000081591,STOCK4S-09181,BAS 12457939,SMR000043310,Molecular Weight410.53574 [g/mol]Molecular FormulaC21H26N6OSXLogP2.6H-Bond Donor0H-Bond Acceptor7Rotatable Bond Count2Exact Mass410.18888MonoIsotopic Mass410.18888Topological Polar Surface Area57.6
[Synonyms]
MLS000081591
STOCK4S-09181
BAS 12457939
SMR000043310

[Structure]
MLS000081591,STOCK4S-09181,BAS 12457939,SMR000043310,Molecular Weight4

[ Properties Computed from Structure]
Molecular Weight410.53574 [g/mol]
Molecular FormulaC21H26N6OS
XLogP2.6
H-Bond Donor0
H-Bond Acceptor7
Rotatable Bond Count2
Exact Mass410.18888
MonoIsotopic Mass410.18888
Topological Polar Surface Area57.6
Heavy Atom Count29
Formal Charge0
Complexity584
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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