COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457659
Chemical Name: methyl2-({[2-({5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}carbonyl)hydrazinyl]carbonothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NNC(=O)c2ccc(o2)Cn2nc(c(c2)Br)[N+](=O)[O-])sc2c1CCC2

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Molecular Weight: 569.42
Empirical Formula: C19H17BrN6O6S2

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 4.344
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 216
Number of rings: 4

     

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