COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078959
Chemical Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cc2OCOc2cc1Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 380.81
Empirical Formula: C15H13ClN4O4S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 1.215
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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