COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164664
Chemical Name: 2-[({2-[4-(chloroacetyl)piperazin-1-yl]ethyl}amino)methylidene]-5,5-dimethylcyclohexane-1,3-dione
Smiles: ClCC(=O)N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 355.86
Empirical Formula: C17H26ClN3O3

Physical State: Dry powder
Available Amount: 551 mg

Lipinsky:
logP: 0.207
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 2

     

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