COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529049
Chemical Name: 3-{[(4,6-dihydroxy-5-pentylpyrimidin-2-yl)sulfanyl]acetyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: CCCCCc1c(O)nc(nc1O)SCC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 444.55
Empirical Formula: C22H28N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.823
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 4

     

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