COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526024
Chemical Name: 5-[(5-bromothiophen-2-yl)methyl]-1,3-dimethyl-5-{[(1R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Brc1ccc(s1)CC1(CN2CC3C[C@@H](C2)c2n(C3)c(=O)ccc2)C(=O)N(C)C(=O)N(C1=O)C

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Molecular Weight: 533.45
Empirical Formula: C23H25BrN4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.262
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 109
Number of rings: 5

     

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