COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897616
Chemical Name: 3-[(9-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]propanoicacid
Smiles: CCn1c(SCCC(=O)O)nc2c1n(C)c(=O)n(c2=O)C

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Molecular Weight: 312.35
Empirical Formula: C12H16N4O4S

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 1.678
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 2

     

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