COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532050
Chemical Name: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7-ethyl-4,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccc(cc3)Cl)nnc2n(c1=O)C

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Molecular Weight: 489.02
Empirical Formula: C22H21ClN4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.596
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 130
Number of rings: 5

     

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