MMsINC Database Search
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Ligand PDB



ligand: BNE
Name: 2-[3-(3-ETHYL-1-METHYL-2-OXO-AZEPAN-3-YL)-PHENOXY]-4-[1-AMINO-1-(1-METHYL-1H-IMIDIZOL-5-YL)-
ETHYL]-BENZONITRILE
SMILES: CCC1(CCCCN(C1=O)C)c2cccc(c2)Oc3cc(ccc3C#N)C(C)(c4cncn4C)N
[show PDB table]


MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 16096Ionic States: 959Tautomers: 1646Drug Similarity: 0 Items found 81 - 100 of 16096 



of 805    Go to Page   



MMs03094553
tanimoto score: 0.81

MMs01136127
tanimoto score: 0.81

MMs01155466
tanimoto score: 0.81

MMs03094494
tanimoto score: 0.81

MMs01129858
tanimoto score: 0.81

MMs01158247
tanimoto score: 0.81

MMs01148122
tanimoto score: 0.81

MMs01158056
tanimoto score: 0.81

MMs01158054
tanimoto score: 0.81

MMs01158055
tanimoto score: 0.81

MMs01129734
tanimoto score: 0.81

MMs01148121
tanimoto score: 0.81

MMs01129736
tanimoto score: 0.81

MMs01129798
tanimoto score: 0.81

MMs01155465
tanimoto score: 0.81

MMs01136126
tanimoto score: 0.81

MMs01129865
tanimoto score: 0.81

MMs03094449
tanimoto score: 0.81

MMs03094496
tanimoto score: 0.81

MMs01155395
tanimoto score: 0.81


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