COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188888
Chemical Name: methyl3-{[(2E)-3-(4-chlorophenyl)prop-2-enoyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=O)/C=C/c1ccc(cc1)Cl)N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 503.98
Empirical Formula: C28H26ClN3O4

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 4.004
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 4

     

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