COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK679538
Chemical Name: ethyl3-[({[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]-3-(4-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)CSc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 600.09
Empirical Formula: C28H30ClN5O6S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 5.162
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 148
Number of rings: 4

     

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