COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371599
Chemical Name: (5Z)-5-{[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Smiles: CCN1C(=S)N/C(=C\c2cc(n(c2C)c2ccc(cc2)[N+](=O)[O-])C)/C1=O

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Molecular Weight: 370.43
Empirical Formula: C18H18N4O3S

Physical State: Dry powder
Available Amount: 880 mg

Lipinsky:
logP: 4.068
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 3

     

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