MMsINC Database Search
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Ligand PDB



ligand: AB8
Name: (1S,3R,8AS)-8-(2-{(4S,6S)-3-(4-HYDROXY-3-METHOXYBENZYL)-4-[2-(METHYLAMINO)-2-OXOETHYL]-2-OXO-
1,3-OXAZINAN-6-YL}ETHYL)-3,7-DIMETHYL-1,2,3,7,8,8A-HEXAHYDRONAPHTHALEN-1-YL (2R)-2-METHYLBUTANOATE
SMILES: C
CC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(N(C(=O)O3)Cc4ccc(c(c4)OC)O)CC(=O)NC)C
[show PDB table]


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

Neutral Molecules: 44173Ionic States: 21834Tautomers: 9013Drug Similarity: 75 Items found 1 - 20 of 44173 



of 2209    Go to Page   



MMs03817179
tanimoto score: 0.87

MMs03859919
tanimoto score: 0.87

MMs03860077
tanimoto score: 0.87

MMs03817180
tanimoto score: 0.87

MMs03814420
tanimoto score: 0.87

MMs03814421
tanimoto score: 0.87

MMs03859926
tanimoto score: 0.87

MMs03860083
tanimoto score: 0.87

MMs03841027
tanimoto score: 0.86

MMs03841036
tanimoto score: 0.86

MMs01821962
tanimoto score: 0.86

MMs03841009
tanimoto score: 0.86

MMs03841018
tanimoto score: 0.86

MMs03413576
tanimoto score: 0.86

MMs03578429
tanimoto score: 0.86

MMs03578423
tanimoto score: 0.86

MMs01775235
tanimoto score: 0.86

MMs03578424
tanimoto score: 0.86

MMs01821961
tanimoto score: 0.86

MMs01775234
tanimoto score: 0.86


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