COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188136
Chemical Name: 5-{[1-(4-methoxy-2-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1ccc(c(c1)[N+](=O)[O-])n1c(C)cc(c1C)C=C1C(=O)N(C)C(=S)N(C1=O)C

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Molecular Weight: 428.47
Empirical Formula: C20H20N4O5S

Physical State: Dry powder
Available Amount: 163 mg

Lipinsky:
logP: 2.998
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 132
Number of rings: 3

     

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