COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK721414
Chemical Name: 8-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(c1nc2sc3c(c2c2c1CCCC2)ncnc3SCc1ccc2c(c1)OCO2)C

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Molecular Weight: 449.6
Empirical Formula: C24H23N3O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.777
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 6

     

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