COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529206
Chemical Name: 5-(anthracen-9-ylmethyl)-1,3-dimethyl-5-{[(1R,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]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2

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Molecular Weight: 564.71
Empirical Formula: C33H32N4O3S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.796
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 7

     

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