Sanitize It Yourself
Login with Twitter
Molecule Viewer
― Demo
Nearest neighbor of
Go to project home
👎 to all
👍 to all
Clear Evaluations
Export
Rendering molecules...
Details
Substructure Search
Nearest Neighbor Search
C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(N4CCOCC4)cc3)cc2[N+](=O)[O-])C1
Ro5
PAINS
👎
1
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)N1CCN(Cc2ccccc2)CC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CC[C@H]([NH+]2CCCC2)C1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
C#CCN(C[C@H]1CCCO1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(N[C@H]1CCCC[C@H]1OC1CCCC1)c1ccc([N+](=O)[O-])cc1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(Cc1ccc([N+](=O)[O-])cc1)NCC1(O)CCOCC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(Nc1cccc2ccccc12)NC1CC[NH+](CC(F)F)CC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C1C(=O)N(CC[NH+]2CCOCC2)[C@@H](c2cccc([N+](=O)[O-])c2)/C1=C(\O)c1cccs1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
CCN(CCO)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(CCNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]([NH+]2CCCC2)C1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(CN(C(=O)Cn1nnc2ccccc21)c1ccccc1)NC[C@H]1CCCO1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
CC(=O)Nc1ccc(CN2CC[NH+](C3CCCC3)[C@H](CCO)C2)cc1
Ro5
👎
👍
«
1
»