COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741693
Chemical Name: 2-{[(2-{4-[(4-fluorophenyl)acetyl]piperazin-1-yl}ethyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C(N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C)Cc1ccc(cc1)F

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Molecular Weight: 415.51
Empirical Formula: C23H30FN3O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.738
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 3

     

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