COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123596
Chemical Name: 2-(4-{2-[2-(butan-2-yl)phenoxy]ethoxy}-3-chloro-5-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(cc(c1OCCOc1ccccc1C(CC)C)Cl)c1nc2sc3c(c2c(=O)[nH]1)CCCC3

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Molecular Weight: 539.09
Empirical Formula: C29H31ClN2O4S

Physical State: Dry powder
Available Amount: 349 mg

Lipinsky:
logP: 7.889
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 97
Number of rings: 5

     

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