COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK836189
Chemical Name: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-(propan-2-yl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CC(OCc1s2)C(C)C

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Molecular Weight: 519.48
Empirical Formula: C23H23BrN2O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.469
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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