| ID LINK | NAME | STRUCTURE CAS | MW | ALogP | nHBAcc | nHBDon | nRotB | arR |
|---|---|---|---|---|---|---|---|---|
| Insec102 | hydrogen cyanide |
 74-90-8 |
27.025 | 0.568 | 1 | 0 | 0 | 0 |
| Insec108 | phosphine |
 7803-51-2 |
33.998 | 0 | 0 | 0 | 0 | 0 |
| Insec101 | ethylene oxide |
 75-21-8 |
44.053 | -0.131 | 1 | 0 | 0 | 0 |
| Insec094 | cyanogen |
 2074-87-5 |
52.035 | 0.069 | 2 | 0 | 0 | 0 |
| Insec088 | acrylonitrile |
 107-13-1 |
53.063 | 0.636 | 1 | 0 | 0 | 0 |
| Insec091 | carbon disulfide |
 75-15-0 |
60.075 | 0.752 | 1 | 0 | 0 | 0 |
| Insec111 | boric acid |
 10043-35-3 |
61.833 | -1.381 | 3 | 3 | 0 | 0 |
| Insec098 | ethyl formate |
 109-94-4 |
74.079 | 0.193 | 2 | 0 | 2 | 0 |
| Insec089 | carbon disulfide |
 75-15-0 |
76.141 | 1.651 | 0 | 0 | 0 | 0 |
| Insec106 | methylene chloride |
 75-09-2 |
84.933 | 1.073 | 0 | 0 | 0 | 0 |
495 ,
50
