COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525419
Chemical Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3-dimethyl-5-{[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C)C(=O)C(C(=O)N1C)(CN1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 508.6
Empirical Formula: C26H28N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.197
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 114
Number of rings: 6

     

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