COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK558550
Chemical Name: 1-(4-chlorophenyl)-2-{[10-ethyl-10-methyl-5-(propylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Smiles: CCCSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)CC(OC3)(C)CC

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Molecular Weight: 533.14
Empirical Formula: C24H25ClN4O2S3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 8.922
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 148
Number of rings: 5

     

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