COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL417102
Chemical Name: (5E)-1-(2-chlorobenzyl)-5-{[2,5-dimethyl-1-(3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1cc(n(c1C)c1cccc(c1)[N+](=O)[O-])C)Cc1ccccc1Cl

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Molecular Weight: 478.89
Empirical Formula: C24H19ClN4O5

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.838
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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