COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057415
Chemical Name: (5E)-1-cyclohexyl-5-{[(4-{[2-(diethylammonio)ethoxy]carbonyl}phenyl)amino]methylidene}-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: CC[NH+](CCOC(=O)c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)C1CCCCC1)[S-])CC

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Molecular Weight: 472.61
Empirical Formula: C24H32N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.269
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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