COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807730
Chemical Name: 2-(3-{[5-(3,4-dimethoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: COc1cc(ccc1OC)c1nnc(n1C)SCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 488.57
Empirical Formula: C26H24N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.596
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 5

     

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