COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK577727
Chemical Name: 1,3-dimethyl-5-(5-nitro-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}benzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=Cc2cc(ccc2N2CCN(CC2)C/C=C/c2ccccc2)[N+](=O)[O-])C(=O)N1C

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Molecular Weight: 489.53
Empirical Formula: C26H27N5O5

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 3.065
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 109
Number of rings: 4

     

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