COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188912
Chemical Name: methyl3-{[(5-bromo-2-methoxyphenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)c1cc(Br)ccc1OC)N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 552.42
Empirical Formula: C27H26BrN3O5

Physical State: Dry powder
Available Amount: 359 mg

Lipinsky:
logP: 3.329
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 88
Number of rings: 4

     

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