COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043511
Chemical Name: (5E)-1-(2-chlorophenyl)-5-[({4-[ethyl(2-hydroxyethyl)amino]phenyl}amino)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: OCCN(c1ccc(cc1)N/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1Cl)S)CC

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Molecular Weight: 444.94
Empirical Formula: C21H21ClN4O3S

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 3.108
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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