COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839332
Chemical Name: 2-(2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(CCSc2nnc(n2c2ccccc2)c2cccs2)C(=O)c2c1cccc2

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Molecular Weight: 432.53
Empirical Formula: C22H16N4O2S2

Physical State: Dry powder
Available Amount: 379 mg

Lipinsky:
logP: 6.304
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 121
Number of rings: 5

     

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