COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245769
Chemical Name: N-[(4-ethyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Smiles: CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCc1nc2ccccc2c(=O)[nH]1

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Molecular Weight: 464.5
Empirical Formula: C22H20N6O4S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 2.031
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 5

     

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