COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK084071
Chemical Name: 5-nitro-2-{4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}benzonitrile
Smiles: N#Cc1cc(ccc1Oc1ccc(cc1)C=C1C(=O)NC(=O)NC1=O)[N+](=O)[O-]

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Molecular Weight: 378.3
Empirical Formula: C18H10N4O6

Physical State: Dry powder
Available Amount: 237 mg

Lipinsky:
logP: 2.369
Rotatable bonds: 1
H-donors: 2
H-acceptors: 6
PSA: 154
Number of rings: 3

     

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