COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK325135
Chemical Name: 2-{[(6-amino-9H-purin-8-yl)sulfanyl]methyl}-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Smiles: O=c1n(c2cccc(c2)C(F)(F)F)c(CSc2[nH]c3c(n2)c(N)ncn3)nc2c1cccc2

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Molecular Weight: 469.45
Empirical Formula: C21H14F3N7OS

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 2.597
Rotatable bonds: 3
H-donors: 3
H-acceptors: 1
PSA: 138
Number of rings: 5

     

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