COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK437292
Chemical Name: methyl2-[({2-[2-(1,3-benzodioxol-5-yloxy)propanoyl]hydrazinyl}carbonothioyl)amino]-4,5-dimethylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NNC(=O)C(Oc2ccc3c(c2)OCO3)C)sc(c1C)C

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Molecular Weight: 451.52
Empirical Formula: C19H21N3O6S2

Physical State: Dry powder
Available Amount: 369 mg

Lipinsky:
logP: 5.039
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 167
Number of rings: 3

     

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