Compound Summary (CID 25244192) |
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  Compound Information CID 25244192 Create Date: 2009-05-14 Suppressed Compound Properties and Descriptors | Properties | | | | Molecular Weight | | 345.228522 [g/mol] | | Molecular Formula | | C10H14N6O6P- | | XLogP3 | | -3.9 | | H-Bond Donor | | 4 | | H-Bond Acceptor | | 11 | | Rotatable Bond Count | | 4 | | | | | Exact Mass | | 345.071244 | | MonoIsotopic Mass | | 345.071244 | | Topological Polar Surface Area | | 195 | | Heavy Atom Count | | 23 | | Formal Charge | | -1 | | Complexity | | 479 | | Isotope Atom Count | | 0 | | Defined Atom Stereocenter Count | | 4 | | Undefined Atom Stereocenter Count | | 0 | | Defined Bond Stereocenter Count | | 0 | | Undefined Bond Stereocenter Count | | 0 | | Covalently-Bonded Unit Count | | 1 | | | | | Feature 3D Acceptor Count | | 5 | | Feature 3D Donor Count | | 3 | | Feature 3D Anion Count | | 1 | | Feature 3D Cation Count | | 4 | | Feature 3D Ring Count | | 3 | | Effective Rotor Count | | 5 | | Conformer Sampling RMSD | | 0.8 | | CID Conformer Count | | 164 |
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Old Version Substance Information |
