COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188934
Chemical Name: methyl3-{[(2E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)/C=C/c1cc(Br)ccc1OC)N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 578.46
Empirical Formula: C29H28BrN3O5

Available Amount: 0 mg

Lipinsky:
logP: 4.577
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 4

     

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