COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457557
Chemical Name: ethyl2-[({2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinyl}carbonothioyl)amino]-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1cc(sc1NC(=S)NNC(=O)C(n1nc(c(c1)[N+](=O)[O-])OC)C)c1ccccc1

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Molecular Weight: 518.57
Empirical Formula: C21H22N6O6S2

Physical State: Dry powder
Available Amount: 501 mg

Lipinsky:
logP: 5.502
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 212
Number of rings: 3

     

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