COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143162
Chemical Name: 5-(4-methoxyphenyl)-2-[({2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl}amino)methylidene]cyclohexane-1,3-dione
Smiles: COc1ccc(cc1)C1CC(=O)/C(=C/NCCN2CCN(CC2)C(=O)c2ccccc2)/C(=O)C1

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Molecular Weight: 461.56
Empirical Formula: C27H31N3O4

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 1.351
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 4

     

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