COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149683
Chemical Name: 2-({[2-(4-hexanoylpiperazin-1-yl)ethyl]amino}methylidene)-5-(4-methoxyphenyl)cyclohexane-1,3-dione
Smiles: CCCCCC(=O)N1CCN(CC1)CCN/C=C/1\C(=O)CC(CC1=O)c1ccc(cc1)OC

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Molecular Weight: 455.6
Empirical Formula: C26H37N3O4

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 2.744
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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