COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK663282
Chemical Name: 2-[({5-[(4-cyclohexylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-3-(4-ethylphenyl)quinazolin-4(3H)-one
Smiles: CCc1ccc(cc1)n1c(CSc2nnc(n2c2ccccc2)COc2ccc(cc2)C2CCCCC2)nc2c(c1=O)cccc2

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Molecular Weight: 627.81
Empirical Formula: C38H37N5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.956
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 7

     

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