COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051492
Chemical Name: (5E)-5-({[4-(diethylammonio)phenyl]amino}methylidene)-4,6-dioxo-1-(3,4,5-trimethoxyphenyl)-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: CC[NH+](c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1cc(OC)c(c(c1)OC)OC)[S-])CC

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Molecular Weight: 484.58
Empirical Formula: C24H28N4O5S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 3.242
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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