COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK021547
Chemical Name: 2-({7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide
Smiles: NC(=O)CSc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C

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Molecular Weight: 343.79
Empirical Formula: C12H14ClN5O3S

Physical State: Dry powder
Available Amount: 491 mg

Lipinsky:
logP: 1.355
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 135
Number of rings: 2

     

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