COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372566
Chemical Name: (5E)-1-(2-methoxyethyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COCCN1C(=S)NC(=O)/C(=C\c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 401.4
Empirical Formula: C18H15N3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.454
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 3

     

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