COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219915
Chemical Name: methyl4-(4-benzylpiperazin-1-yl)-3-{[(4-ethoxy-3-nitrophenyl)carbonyl]amino}benzoate
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cc(ccc1N1CCN(CC1)Cc1ccccc1)C(=O)OC

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Molecular Weight: 518.57
Empirical Formula: C28H30N4O6

Physical State: Dry powder
Available Amount: 136 mg

Lipinsky:
logP: 4.454
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 116
Number of rings: 4

     

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