COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456593
Chemical Name: ethyl2-[({2-[2-(1,3-benzodioxol-5-yloxy)propanoyl]hydrazinyl}carbonothioyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NNC(=O)C(Oc2ccc3c(c2)OCO3)C)sc(c1c1ccccc1)C

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Molecular Weight: 527.62
Empirical Formula: C25H25N3O6S2

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 6.568
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 167
Number of rings: 4

     

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