Molecular Weight:410.40502 [g/mol]
Molecular Formula:C15H18N6O6S
XLogP3-AA:0.6
H-Bond Donor:2
H-Bond Acceptor:7
Rotatable Bond Count:6
Tautomer Count:5
Exact Mass:410.100853
MonoIsotopic Mass:410.100853
Topological Polar Surface Area:161
Heavy Atom Count:28
Formal Charge:0
Complexity:642
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:6
Feature 3D Donor Count:2
Feature 3D Ring Count:2
Effective Rotor Count:9
Conformer Sampling RMSD:1
CID Conformer Count:183