7 Warhead(s) |
Warhead Name | Warhead SMARTS | Warhead Structure |
#Ligands | #Proteins |
#Mechanisms | #Residues |
#Protein-Ligand Complex(es) |
1 | Alkyl Halide | [CX4]-[F,Br,Cl,I] | 31 | 29 | 3 | 7 | 44 | |
2 | Allyl Vinyl Ether | [c][c][O][#6][C]=[C] | 2 | 2 | 2 | 2 | 2 | |
3 | Alpha-Cyclosulfate | O=S1(=O)[#8]-[#6]-[#6]-[#8]1 | 2 | 2 | 1 | 2 | 2 | |
4 | Aziridine | [C;r3][N;r3][C;r3] | 15 | 14 | 1 | 3 | 18 | |
5 | Epoxide | [C;r3][O;r3][C;r3] | 77 | 56 | 3 | 7 | 125 | |
6 | Halomethyl Carbonyl | [*][CX3](=[O])[CX4]-[F,Cl,Br,I] | 112 | 57 | 5 | 7 | 145 | |
7 | Hemiacetal | [OX2H][CX4][OX2][#6] | 30 | 57 | 3 | 8 | 79 |