COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK189439
Chemical Name: (5Z)-1-(3-chlorophenyl)-5-[2-methyl-4-(pyrrolidin-1-yl)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: Clc1cccc(c1)N1C(=S)NC(=O)/C(=C/c2ccc(cc2C)N2CCCC2)/C1=O

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Molecular Weight: 425.94
Empirical Formula: C22H20ClN3O2S

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 4.906
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 4

     

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