COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456533
Chemical Name: methyl4,5-dimethyl-2-({[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCN(CC2)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C

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Molecular Weight: 434.54
Empirical Formula: C19H22N4O4S2

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 5.022
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 150
Number of rings: 3

     

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