COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664419
Chemical Name: 3-(4-ethylphenyl)-2-({[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)quinazolin-4(3H)-one
Smiles: CCc1ccc(cc1)n1c(CSc2nnc(n2c2ccccc2)c2ccc(cc2)OC)nc2c(c1=O)cccc2

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Molecular Weight: 545.66
Empirical Formula: C32H27N5O2S

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 8.175
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 6

     

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