COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006587
Chemical Name: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({[4-(4-ethylpiperazin-1-yl)phenyl]amino}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCN1CCN(CC1)c1ccc(cc1)N/C=C/1\C(=O)NC(=S)N(C1=O)CCC1=CCCCC1

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Molecular Weight: 467.64
Empirical Formula: C25H33N5O2S

Available Amount: 0 mg

Lipinsky:
logP: 3.441
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 100
Number of rings: 4

     

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