COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK539631
Chemical Name: 1-phenyl-2-{[11-(propan-2-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl]sulfanyl}ethanone
Smiles: O=C(c1ccccc1)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

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Molecular Weight: 473.62
Empirical Formula: C25H23N5OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.142
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 126
Number of rings: 6

     

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