COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368101
Chemical Name: (5E)-1-(3,5-dichlorophenyl)-5-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=S)NC(=O)/C(=C\N2CCN(CC2)C(=O)c2ccco2)/C1=O

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Molecular Weight: 479.34
Empirical Formula: C20H16Cl2N4O4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 2.489
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 4

     

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