home← all results complex #837

Complex #837 — Ru(3) [Ru(H2dtpa) (H2O)]

GT: {"O": 3, "N": 3} → Top-1: {"O": 3, "N": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
1
Candidates
{"O": 3, "N": 3}
Ground Truth
{"O": 3, "N": 1}
Top-1 Prediction
0.667
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring. For sequential results only top-1 prediction is stored.
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#1 TOP-1 0.75 ± 0.00
[OH2]->[Ru+3]
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#2 0.00 ± 0.00
O=C(O)CN1CCN(CC(=O)O)CC(=O)[O][Ru]23<-[N](CC1)(CC(=O)[O]2)CC(=O)[O]3
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#3 0.00 ± 0.00
O=C([O-])CN(CCN(CC[N]12->[Ru+]([O]C(=O)C1)[O]C(=O)C2)CC(=O)O)CC(=O)O
#4 0.00 ± 0.00
O=C(O)CN1CCN2CC(=O)[O][Ru]3(<-[N](CC(=O)O)(CC1)CC(=O)[O]3)[O]C(=O)C2
#4 0.00 ± 0.00
O=C(O)CN1CCN2CC(=O)[O][Ru]3(<-[N](CC(=O)O)(CC1)CC(=O)[O]3)[O]C(=O)C2
#4 0.00 ± 0.00
O=C(O)CN1CCN2CC(=O)[O][Ru]3(<-[N](CC(=O)O)(CC1)CC(=O)[O]3)[O]C(=O)C2