COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897578
Chemical Name: 3-{[9-(4-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl]sulfanyl}propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1Cc1ccc(cc1)F)n(C)c(=O)n(c2=O)C

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Molecular Weight: 392.41
Empirical Formula: C17H17FN4O4S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.974
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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