Compound Summary (CID 5281093) |
| | |
  Compound Information CID 5281093 Create Date: 2005-06-24 Suppressed Compound   Properties and Descriptors | Properties | | | | Molecular Weight | | 493.93732 [g/mol] | | Molecular Formula | | C23H28ClN3O7 | | H-Bond Donor | | 6 | | H-Bond Acceptor | | 10 | | Rotatable Bond Count | | 2 | | | | | Exact Mass | | 493.161578 | | MonoIsotopic Mass | | 493.161578 | | Topological Polar Surface Area | | 165 | | Heavy Atom Count | | 34 | | Formal Charge | | 0 | | Complexity | | 971 | | Isotope Atom Count | | 0 | | Defined Atom Stereocenter Count | | 4 | | Undefined Atom Stereocenter Count | | 0 | | Defined Bond Stereocenter Count | | 1 | | Undefined Bond Stereocenter Count | | 0 | | Covalently-Bonded Unit Count | | 2 | | | |
| Descriptors | | | | IUPAC Name | | | | Canonical SMILES | | | | Isomeric SMILES | | |
  Old Version Substance Information SID 10230, Version: 2, Same
SID 10230, Version: 3, Same
SID 10230, Version: 4, Same
SID 10230, Version: 5, Same
SID 10230, Version: 6, Same
SID 775069, Version: 2, Same
SID 775069, Version: 3, Same
SID 7847915, Version: 1, Same
SID 7847915, Version: 2, Same
SID 7847915, Version: 3, Same
SID 7847915, Version: 4, Same
SID 7847915, Version: 5, Same
SID 7847915, Version: 6, Same
SID 24439452, Version: 1, Same
SID 87550941, Version: 1, Same
SID 87550941, Version: 2, Same
SID 95700207, Version: 1, Same
SID 99381020, Version: 1, Same
SID 99381020, Version: 3, Same
SID 99381020, Version: 5, Same
SID 103770864, Version: 1, Same
SID 103770864, Version: 2, Same
SID 123084687, Version: 1, Same
SID 125311903, Version: 1, Same
|