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
#3568 [Ru(DEE)Cl2(H2O)] Ru(3) — 1 candidates
GT: {"N": 2, "O": 1} Pred: {"O": 1, "N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#3703 1b Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#3705 2b Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#3748 [Ru(azpy)(tpy)Cl]Cl·5H2O (1d) Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#3814 3 Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#3849 7 Ru(2) — 2 candidates
GT: {"N": 7} Pred: {"N": 7}
1.00
Candidates → Complex detail MOL 3D Viewer
#3892 R-3b Ru(2) — 2 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 2, "P": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#3914 4 Ru(2) — 2 candidates
GT: {"O": 2, "N": 2} Pred: {"O": 2, "N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#3931 4 Ru(2) — 2 candidates
GT: {"O": 2, "P": 1} Pred: {"O": 2, "P": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#3954 [RuCl3(LLL)] Ru(3) — 1 candidates
GT: {"N": 3} Pred: {"N": 3}
1.00
Candidates → Complex detail MOL 3D Viewer
#3955 RuLLL-azpy Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#3961 cisDRu(III) Ru(3) — 1 candidates
GT: {"O": 2} Pred: {"O": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#4016 Ruthenium metal complex Ru(2) — 1 candidates
GT: {"N": 4} Pred: {"N": 4}
1.00
Candidates → Complex detail MOL 3D Viewer
#4200 1 Ru(2) — 1 candidates
GT: {"N": 2} Pred: {"N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#4202 3 Ru(2) — 1 candidates
GT: {"N": 2} Pred: {"N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#4237 7 Ru(3) — 2 candidates
GT: {"O": 2, "N": 4, "P": 1} Pred: {"N": 4, "O": 2, "P": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4399 8a Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 5}
1.00
Candidates → Complex detail MOL 3D Viewer
#4401 8c Ru(2) — 2 candidates
GT: {"N": 6} Pred: {"N": 6}
1.00
Candidates → Complex detail MOL 3D Viewer
#4404 8f Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 5}
1.00
Candidates → Complex detail MOL 3D Viewer
#4405 9 Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 5}
1.00
Candidates → Complex detail MOL 3D Viewer
#4481 α-[Ru(azpy)(bpy)Cl2] Ru(2) — 2 candidates
GT: {"N": 5} Pred: {"N": 5}
1.00
Candidates → Complex detail MOL 3D Viewer
#4707 2a Ru(2) — 1 candidates
GT: {"N": 4} Pred: {"N": 4}
1.00
Candidates → Complex detail MOL 3D Viewer
#4746 1 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4747 2 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4748 3 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4749 4 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4750 5 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#4753 8 Ru(2) — 2 candidates
GT: {"N": 2, "O": 1} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#6372 3 Re(5) — 2 candidates
GT: {"N": 2, "O": 2} Pred: {"N": 2, "O": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#6862 Rh-4 Rh(3) — 1 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#6863 Rh-5 Rh(3) — 1 candidates
GT: {"O": 1, "N": 2} Pred: {"O": 1, "N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#6868 Rh-10 Rh(3) — 1 candidates
GT: {"O": 1, "N": 2} Pred: {"N": 2, "O": 1}
1.00
Candidates → Complex detail MOL 3D Viewer
#6882 tpatpy-Rh Rh(3) — 1 candidates
GT: {"N": 3} Pred: {"N": 3}
1.00
Candidates → Complex detail MOL 3D Viewer
#6890 Rh1 Rh(3) — 1 candidates
GT: {"N": 3} Pred: {"N": 3}
1.00
Candidates → Complex detail MOL 3D Viewer
#6891 Rh2 Rh(3) — 1 candidates
GT: {"N": 3} Pred: {"N": 3}
1.00
Candidates → Complex detail MOL 3D Viewer
#6953 1 Rh(3) — 1 candidates
GT: {"O": 3, "N": 2} Pred: {"O": 3, "N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#6954 2 Rh(3) — 1 candidates
GT: {"O": 3, "N": 2} Pred: {"O": 3, "N": 2}
1.00
Candidates → Complex detail MOL 3D Viewer
#43 3b,1,3 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#156 Δ-Ru1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#230 3,1,2 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#664 Ru2 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#850 Complex 1 Ru(2) — 2 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#985 Ru1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1173 Ru4 Ru(2) — 2 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1207 Ru1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1226 1 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1365 Ru-UCN1 Ru(2) — 2 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1366 Ru-UCN3 Ru(2) — 2 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1430 RuH-01 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
#1431 RuH-02 Ru(2) — 3 candidates
GT: {"N": 8} Pred: {"N": 9}
0.89
Candidates → Complex detail MOL 3D Viewer
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