COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457556
Chemical Name: methyl5-(diethylcarbamoyl)-2-[({2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinyl}carbonothioyl)amino]-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)NNC(=O)C(n1nc(c(c1)[N+](=O)[O-])OC)C)CC

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Molecular Weight: 541.61
Empirical Formula: C20H27N7O7S2

Physical State: Dry powder
Available Amount: 446 mg

Lipinsky:
logP: 4.091
Rotatable bonds: 9
H-donors: 3
H-acceptors: 7
PSA: 232
Number of rings: 2

     

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