59 Warhead(s)
Warhead Name
Warhead SMARTS
Warhead Structure
#Ligands
#Proteins
#Mechanisms
#Residues
#Protein-Ligand Complex(es)
51 Purine [#7]1:[#6]:[#7]:[#6]2:[#7]:[#6]:[#7]:[#6]:[#6]12 1 1 1 1 2
52 Pyrimidin-2-one [n]1[c](=O)[n][c][c][c]1 1 1 1 1 1
53 Selenic Acid [#6]-[Se](=O)-[OX2H1,OX1-] 1 1 1 1 1
54 Thiol [CX4,c]-[SX2H1,SX1-] 24 22 1 1 30
55 Thioster [#6][CX3](=O)[S][#6] 2 2 1 2 2
56 Thiosulfonate [#6]-[S]-[S]([CX3])(=O)=O 1 1 1 1 2
57 Vinyl Carbonyl [C]=[C]-[CX3](=[O])[*] 235 105 4 5 308
58 Vinyl Nitroalkane [C]=[C]-[N+](=[O])([O-]) 1 1 1 1 2
59 Vinyl Sulfonyl [C]=[C]-[S](=[O])(=[O])[*] 33 16 1 2 38