COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368125
Chemical Name: (5E)-1-(3,5-dichlorophenyl)-5-[4-(1,3-dihydro-2H-isoindol-2-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cc(Cl)cc(c1)N1C(=S)NC(=O)/C(=C\c2ccc(cc2)N2Cc3c(C2)cccc3)/C1=O

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Molecular Weight: 494.4
Empirical Formula: C25H17Cl2N3O2S

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 5.846
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 5

     

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