COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014707
Chemical Name: 2-[3-bromo-5-methoxy-4-(3-phenoxypropoxy)phenyl]-7-tert-butyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(cc(c1OCCCOc1ccccc1)Br)c1[nH]c(=O)c2c(n1)sc1c2CCC(C1)C(C)(C)C

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Molecular Weight: 597.57
Empirical Formula: C30H33BrN2O4S

Physical State: Dry powder
Available Amount: 292 mg

Lipinsky:
logP: 8.103
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 97
Number of rings: 5

     

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