COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455901
Chemical Name: ethyl2-[({2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinyl}carbonothioyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NNC(=O)C(n2nc(c(c2)[N+](=O)[O-])OC)C)sc(c1c1ccccc1)C

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Molecular Weight: 532.6
Empirical Formula: C22H24N6O6S2

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 5.535
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 212
Number of rings: 3

     

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