COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543893
Chemical Name: 3-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-5-ethoxy-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCOc1nc2sc3c(c2c2n1c(SC/C=C(/Cl)\C)nn2)CC(OC3)(C)C

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Molecular Weight: 424.98
Empirical Formula: C18H21ClN4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.153
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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