COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK131533
Chemical Name: 1,3-dimethyl-5-{2-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=Cc2ccccc2Oc2ccc(cc2[N+](=O)[O-])C(F)(F)F)C(=O)N1C

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Molecular Weight: 449.34
Empirical Formula: C20H14F3N3O6

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 2.375
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 112
Number of rings: 3

     

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