COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457992
Chemical Name: methyl2-({[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonothioyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)N1CCN(CC1)Cc1ccc2c(c1)OCO2)CC

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Molecular Weight: 532.69
Empirical Formula: C25H32N4O5S2

Physical State: Dry powder
Available Amount: 420 mg

Lipinsky:
logP: 4.745
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 4

     

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