COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187289
Chemical Name: (5E)-5-[(2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C=CCN1C(=S)NC(=O)/C(=C\C=C\c2ccccc2[N+](=O)[O-])/C1=O

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Molecular Weight: 343.36
Empirical Formula: C16H13N3O4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 1.714
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 127
Number of rings: 2

     

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