COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531455
Chemical Name: 3-benzyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-8-ethyl-8-methyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCC(=O)c1ccc(cc1)Br)Cc1ccccc1

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Molecular Weight: 564.5
Empirical Formula: C28H26BrN3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.441
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 5

     

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