COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526715
Chemical Name: 1-(4-ethylphenyl)-5-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-5-(3,4,5-trimethoxybenzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)C(C1=O)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 614.7
Empirical Formula: C34H38N4O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.152
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 117
Number of rings: 6

     

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