COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230386
Chemical Name: N-(4-chlorophenyl)-2-(4-ethyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide
Smiles: CCn1c(nnc1SCc1nc2ccccc2c(=O)[nH]1)CC(=O)Nc1ccc(cc1)Cl

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Molecular Weight: 454.94
Empirical Formula: C21H19ClN6O2S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 3.809
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 126
Number of rings: 4

     

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