COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262627
Chemical Name: 4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)c1nc2c([nH]1)c(=O)n(c(=O)n2C)C)NCc1ccco1

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Molecular Weight: 403.47
Empirical Formula: C17H21N7O3S

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 0.057
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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