COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL360885
Chemical Name: 2-{2-[4-(prop-2-en-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: C=CCn1c(n[nH]c1=S)CCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 364.43
Empirical Formula: C19H16N4O2S

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 0.928
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 4

     

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