COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187419
Chemical Name: (5E)-5-{[1-(4-bromo-3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CN1C(=S)NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)Cl)Br)C)/C1=O

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Molecular Weight: 452.76
Empirical Formula: C18H15BrClN3O2S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.562
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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