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
COc1ccccc1NC(=O)[C@@H]1CCCN(C(=O)Nc2cccs2)C1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
COc1ccc(NC(=O)N2CCN(C(=O)Cc3csc4ccccc34)CC2)cc1OC
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(NCCCc1ccccc1)C1CCN(C(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)CC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
Cc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)NCCC(C)C
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
CCc1sc(C(=O)N2CCN([C@@H](C(N)=O)c3ccccc3)CC2)cc1C
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C1N=C(N2CCCCC2)S/C1=C1/C(=O)Nc2ccccc21
Ro5
PAINS
👎
1
👍
Details
Substructure Search
Nearest Neighbor Search
C#CCOc1ccccc1CN1CCN(C2=[NH+]C[C@@H](C)S2)CC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(Cn1nnn(-c2cccs2)c1=O)NC[C@@H]1CN(Cc2ccccc2)CCO1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
Cc1ccc(/C=C2/SC(=S)N(CCC(=O)N3CCCc4ccccc43)C2=O)cc1
Ro5
PAINS
👎
1
👍
Details
Substructure Search
Nearest Neighbor Search
O=C(CC[C@@H]1NC(=O)NC1=O)NC1CCN(c2ccccc2F)CC1
Ro5
👎
👍
Details
Substructure Search
Nearest Neighbor Search
CCCCOc1ccccc1/C=C1\SC(N2CCC(C)CC2)=NC1=O
Ro5
PAINS
👎
1
👍
Details
Substructure Search
Nearest Neighbor Search
NC(=O)[C@@H]1CCCN(C(=O)Cn2nc(-c3cccs3)oc2=O)C1
Ro5
👎
👍
«
1
»