COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135608
Chemical Name: 5-(4-methoxyphenyl)-2-({[2-(piperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione
Smiles: COc1ccc(cc1)C1CC(=O)/C(=C/NCCN2CCNCC2)/C(=O)C1

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Molecular Weight: 357.45
Empirical Formula: C20H27N3O3

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 0.821
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 70
Number of rings: 3

     

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