COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL122316
Chemical Name: N-[3-(methylsulfanyl)phenyl]-2-[5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetamide
Smiles: C=CCn1c(nnc1SCc1nc2ccccc2c(=O)[nH]1)CC(=O)Nc1cccc(c1)SC

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Molecular Weight: 478.6
Empirical Formula: C23H22N6O2S2

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 4.232
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 151
Number of rings: 4

     

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