COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK828517
Chemical Name: (5E)-1-(2,5-dimethoxyphenyl)-5-[(2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)N1C(=O)NC(=O)/C(=C\C=C\c2ccccc2[N+](=O)[O-])/C1=O)OC

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Molecular Weight: 423.38
Empirical Formula: C21H17N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.878
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 3

     

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