chemical compound

[[[:साँचा:chemCompounds.name]]]

Image link of the compound साँचा:chemCompounds.image link.

IUPAC (International Union of Pure and Applied Chemistry) name of the compound is [[[:साँचा:chemCompounds.IUPAC]]].

[[[:साँचा:chemCompounds.name]]] is a yeast anticancer drug compound. Its molecular weight formula is साँचा:chemCompounds.Molecular formula and has molecular weight साँचा:chemCompounds.Molecular Weight. The synonyms of the compound are साँचा:chemCompounds.compounds synonyms.

The physical and chemical properties of [[[:साँचा:chemCompounds.name]]] are given below -

1. Exact Mass : The exact mass of an isotopic species is obtained by summing the masses of the individual isotopes of the molecule. The exact mass of the compound is साँचा:chemCompounds.Exact Mass.

2. Monoisotopic Mass : The monoisotopic mass is the sum of the masses of the atoms in a molecule using the unbound, ground-state, rest mass of the principal (most abundant) isotope for each element instead of the isotopic average mass. The monoisotopic mass is साँचा:chemCompounds.Monoisotopic Mass.

3. Heavy Atom : Any atom except hydrogen in a chemical structure. The number of the heavy atoms in the compound is साँचा:chemCompounds.Heavy Atom Count.

4. Topological Surface : The topological polar surface area (TPSA) of a molecule is defined as the surface sum over all polar atoms in a molecule. The topological surface of the compound is साँचा:chemCompounds.Topological Polar Surface Area.

5. XLogP3_AA : It is computed Octanol/Water Partition Coefficient in a compound. The XLogP3_AA of the compound is साँचा:chemCompounds.XLogP3 AA.

6. Formal Charge : Difference between the number of valence electrons of each atom and the number of electrons the atom is associated with. There {% if chemCompounds.Formal_Charge %}is साँचा:chemCompounds.Formal Charge formal charge on the compound. {% else %}is no formal charge on the compound.{% endif %}

7. Isotope Atom : The number of isotopes that are not most abundant for the corresponding chemical elements. There {% if chemCompounds.Isotope_Atom_Count %}are a total साँचा:chemCompounds.Isotope Atom Countisotope atoms in the compound.{% else %}is no isotope atom in the compound.{% endif %}

8. Hydrogen Bond Acceptor Count: The number of hydrogen bond acceptors in the structure. It has {% if chemCompounds.Hydrogen_Bond_Acceptor_Count %}a total साँचा:chemCompounds.Hydrogen Bond Acceptor Count hydrogen bond acceptors. {% else %}no hydrogen bond acceptors. {% endif %}

9. Hydrogen Bond Donor Count : The number of hydrogen bond donors in the structure. It has {% if chemCompounds.Hydrogen_Bond_Donor_Count %}a total साँचा:chemCompounds.Hydrogen Bond Donor Count hydrogen bond donors. {% else %}no hydrogen bond donor. {% endif %}

10. Rotatable Bond : A rotatable bond is defined as any single-order non-ring bond, where atoms on either side of the bond are in turn bound to nonterminal heavy (i.e., non-hydrogen) atoms. That is, where rotation around the bond axis changes the overall shape of the molecule, and generates conformers which can be distinguished by standard fast spectroscopic methods. There {% if chemCompounds.Rotatable_Bond_Count %}are a total साँचा:chemCompounds.Rotatable Bond Count number of rotatable bonds in the compound. {% else %} is no rotatable bonds in the compound. {% endif %}

11. Covalently Bonded Unit : The number of separate chemical structures not connected by covalent bonds. There {% if chemCompounds.Covalently_Bonded_Unit_Count %}are a total साँचा:chemCompounds.Covalently Bonded Unit Count number of covalently bonded units. {% else %} is no covalently bonded unit {% endif %}in the compound.

12. Complexity : The complexity rating of a compound is a rough estimate of how complicated a structure is, seen from both the point of view of the elements contained and the displayed structural features including symmetry. This complexity rating is computed using the Bertz/Hendrickson/Ihlenfeldt formula. The complexity of the compound is साँचा:chemCompounds.Complexity.

13. Atom Stereocenter : An atom stereocenter, also known as a chiral center, is an atom that is attached to four different types of atoms (or groups of atoms) in the tetrahedral arrangement. The define atom stereocenter count is साँचा:chemCompounds.Defined Atom Stereocenter Count and undefine atom stereocenter count is साँचा:chemCompounds.Undefined Atom Stereocenter Count in the compound.

14. Bond Stereocenter : A bond stereocenter is a non-rotatable bond around which two atoms can have different arrangement (as in cis- and trans-forms of butene around its double bond). Some compounds have an undefined bond stereocenter, whose stereochemistry is not specifically defined. The define bond stereocenter count is साँचा:chemCompounds.Defined Bond Stereocenter Count and the undefine bond stereocenter count is साँचा:chemCompounds.Undefined Bond Stereocenter Count in the compound.

References : https://pubchemdocs.ncbi.nlm.nih.gov/bioassay-data-table-widget-example