COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK755407
Chemical Name: 1,3-dimethyl-5-{3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(=Cc2ccc(c(c2)[N+](=O)[O-])Sc2nc3c(s2)cc(cc3)[N+](=O)[O-])C(=O)N1C

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Molecular Weight: 499.48
Empirical Formula: C20H13N5O7S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.466
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 215
Number of rings: 4

     

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