COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262618
Chemical Name: 4-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-N-(4-phenoxyphenyl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C)Nc1ccc(cc1)Oc1ccccc1

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Molecular Weight: 491.57
Empirical Formula: C24H25N7O3S

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 2.371
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 129
Number of rings: 5

     

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