COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759585
Chemical Name: methyl4-({[4-(cyanomethyl)piperazin-1-yl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CN1CCN(CC1)CC#N

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Saltdata: C2H2O4
Molecular Weight: 316.36
Empirical Formula: C16H20N4O3

Physical State: Dry powder
Available Amount: 217 mg

Lipinsky:
logP: 1.488
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 85
Number of rings: 2

     

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