COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148406
Chemical Name: N-(4-{[(4Z)-2,6-dimethoxypyrimidin-4(3H)-ylidene]sulfamoyl}phenyl)-6-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)hexanamide
Smiles: COc1nc(OC)[nH]/c(=N\S(=O)(=O)c2ccc(cc2)NC(=O)CCCCCn2c(=O)c3cccc4c3c(c2=O)ccc4)/c1

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Molecular Weight: 603.66
Empirical Formula: C30H29N5O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.017
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 164
Number of rings: 5

     

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