COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219940
Chemical Name: ethyl3-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(c(c1)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 528.56
Empirical Formula: C29H28N4O6

Physical State: Dry powder
Available Amount: 331 mg

Lipinsky:
logP: 3.911
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 124
Number of rings: 4

     

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