COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK846648
Chemical Name: (5E)-5-({1-[3-bromo-4-(morpholin-4-yl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-6-hydroxy-2-sulfanylpyrimidin-4(5H)-one
Smiles: SC1=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(c(c2)Br)N2CCOCC2)C)/C(=N1)O

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Molecular Weight: 489.39
Empirical Formula: C21H21BrN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.251
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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