homecomplexesD-MPNN

D-MPNN Donor Prediction

Sequential multi-lig (7058) — 7058 complexes
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)⇄ Compare
87
Exact (1.0)
2026
Partial (>0)
4945
No match
0.159
Mean score
Reset
#5247 2-O-IrAn Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5248 Ir-pzpy Ir(3) — 3 candidates
GT: {"N": 5} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#5249 Ir-TAP Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#5250 TIr-3 Ir(3) — 3 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5251 TIr-4 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 5}
0.00
Candidates → Complex detail MOL 3D Viewer
#5252 LIr1 Ir(3) — 4 candidates
GT: {"O": 2, "N": 2} Pred: {"O": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#5253 Ir-1 Ir(3) — 3 candidates
GT: {"N": 8} Pred: {"N": 6}
0.00
Candidates → Complex detail MOL 3D Viewer
#5254 1 Ir(3) — 3 candidates
GT: {"N": 4, "O": 1} Pred: {"N": 3, "O": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5255 2 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#5256 3 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#5257 4 Ir(3) — 3 candidates
GT: {"N": 2, "P": 2} Pred: {"N": 2, "P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5258 1A Ir(3) — 2 candidates
GT: {"N": 2} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5259 2B Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5260 3A Ir(3) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#5261 3B Ir(3) — 2 candidates
GT: {"N": 2} Pred: {"N": 4}
0.00
Candidates → Complex detail MOL 3D Viewer
#5262 4A Ir(3) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5263 4B Ir(3) — 2 candidates
GT: {"N": 2} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5264 [1]+ Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5265 [2]+ Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5266 [3]+ Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5267 [4]+ Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5268 [5]+ Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5269 [(η5-C5Me5)Ir(L1)Cl]PF6 (1A) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5270 [(η5-C5Me4C6H5)Ir(L1)Cl]PF6 (1B) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5271 [(η5-C5Me4C6H4C6H5)Ir(L1)Cl]PF6 (1C) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5272 [(η5-C5Me5)Ir(L2)Cl]PF6 (2A) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5273 [(η5-C5Me4C6H5)Ir(L2)Cl]PF6 (2B) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5274 [(η5-C5Me4C6H4C6H5)Ir(L2)Cl]PF6 (2C) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5275 [(η5-C5Me5)Ir(L3)Cl]PF6 (3A) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5276 [(η5-C5Me4C6H5)Ir(L3)Cl]PF6 (3B) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5277 [(η5-C5Me4C6H4C6H5)Ir(L3)Cl]PF6 (3C) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5278 [(η5-C5Me5)Ir(L4)Cl]PF6 (4A) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5279 [(η5-C5Me4C6H5)Ir(L4)Cl]PF6 (4B) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5280 [(η5-C5Me4C6H4C6H5)Ir(L4)Cl]PF6 (4C) Ir(3) — 2 candidates
GT: {"N": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5281 Ir1 Ir(3) — 2 candidates
GT: {"P": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5282 Ir2 Ir(3) — 2 candidates
GT: {"P": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5283 Ir3 Ir(3) — 2 candidates
GT: {"P": 2} Pred: {"P": 2}
0.00
Candidates → Complex detail MOL 3D Viewer
#5284 Ir4 Ir(3) — 2 candidates
GT: {"P": 2} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5285 Ir2 Ir(3) — 4 candidates
GT: {"N": 6} Pred: {"N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#5286 Ir3 Ir(3) — 4 candidates
GT: {"N": 6} Pred: {"N": 3}
0.00
Candidates → Complex detail MOL 3D Viewer
#5287 IrP Ir(3) — 4 candidates
GT: {"N": 4} Pred: {"N": 7}
0.00
Candidates → Complex detail MOL 3D Viewer
#5288 1 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5289 2 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"N": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5290 2 Ir(3) — 2 candidates
GT: {"N": 1} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5291 1 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#5292 2 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#5293 3 Ir(3) — 3 candidates
GT: {"N": 6} Pred: {"N": 9}
0.00
Candidates → Complex detail MOL 3D Viewer
#5294 Ir1 Ir(3) — 3 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
#5295 Ir2 Ir(3) — 3 candidates
GT: {"N": 4} Pred: {"S": 1}
0.00
Candidates → Complex detail MOL 3D Viewer
#5296 Ir3 Ir(3) — 3 candidates
GT: {"N": 4} Pred: C:6(eta)
0.00
Candidates → Complex detail MOL 3D Viewer
«‹ 107108109110111112113114115116 ›» 112/142 (7058 total)