COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019570
Chemical Name: 2-{3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl}-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(cc(c1OCCOc1ccc(cc1)C(C)(C)C)Br)c1[nH]c(=O)c2c(n1)sc1c2CCC(C1)C

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Molecular Weight: 597.57
Empirical Formula: C30H33BrN2O4S

Physical State: Dry powder
Available Amount: 453 mg

Lipinsky:
logP: 8.114
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 97
Number of rings: 5

     

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