COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183517
Chemical Name: methyl4-(4-acetylpiperazin-1-yl)-3-{[(4-methyl-3-nitrophenyl)carbonyl]amino}benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)N1CCN(CC1)C(=O)C

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Molecular Weight: 440.46
Empirical Formula: C22H24N4O6

Physical State: Dry powder
Available Amount: 218 mg

Lipinsky:
logP: 2.029
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 124
Number of rings: 3

     

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