COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054768
Chemical Name: (5Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(4-ethoxyphenyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1ccc(cc1)N/C=C\1/C(=O)N=C(N(C1=O)CCC1=CCCCC1)S

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Molecular Weight: 399.51
Empirical Formula: C21H25N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.252
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 109
Number of rings: 3

     

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