COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK021307
Chemical Name: (6E)-6-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1nn2c(=NC(=O)/C(=C/c3ccc(o3)c3ccc(cc3Br)[N+](=O)[O-])/C2=N)s1

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Molecular Weight: 474.29
Empirical Formula: C18H12BrN5O4S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 153
Number of rings: 4

     

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