The histamine phosphate (23297-93-0) toxicology data, computational chemistry data

 A, toxicological data

Venous LD50:333mg/kg venous LD50:2763ug/kg mice; rabbit; rabbit intestinalLDLo:1 mg/kg vein LD50:608ug/kg; guinea pigs;

Guinea pig intestinal LD50:746ug/kg;

Two, the calculation of chemical data

2, hydrogen bond donor number: 8

3, the number of hydrogen bond acceptor: 10

4, the number of chemical bonds: 2 rotation

5, tautomers quantity: 2

6, topological polar molecular surface area (TPSA): 210

9, complexity: 115

10, the number of atoms: 0

11, determine the number of atoms in the center: 0

11, determine the number of atoms in the center: 0

12, do not determine the number of atomic stereocenter: 0

13, determine the chemical bond stereocenter quantity: 0

13, determine the chemical bond stereocenter quantity: 0

14, do not determine the chemical bond stereocenter quantity: 0