COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546687
Chemical Name: (3aS,4S,6aR)-4-{5-[2-(1-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]-5-oxopentyl}tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
Smiles: O=C1N[C@@H]2[C@H](N1)[C@@H](SC2)CCCCC(=O)N1CCCCC1c1nc2c(n1C)cccc2

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Molecular Weight: 441.6
Empirical Formula: C23H31N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.47
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 104
Number of rings: 5

     

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