COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187267
Chemical Name: 1,3-dimethyl-5-[(2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C)C(=O)C(=C/C=C/c2ccccc2[N+](=O)[O-])C(=O)N1C

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Molecular Weight: 331.35
Empirical Formula: C15H13N3O4S

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 0.611
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 118
Number of rings: 2

     

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