COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922469
Chemical Name: 1-(1,3-benzodioxol-5-yl)-2-(7H-purin-6-ylsulfanyl)ethanone
Smiles: O=C(c1ccc2c(c1)OCO2)CSc1ncnc2c1[nH]cn2

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Molecular Weight: 314.32
Empirical Formula: C14H10N4O3S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 1.466
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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