COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL052316
Chemical Name: 3-(2-{(Z)-[1-(2-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-pyrrol-1-yl)benzoicacid
Smiles: OC(=O)c1cccc(c1)n1cccc1/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1C)S

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Molecular Weight: 431.47
Empirical Formula: C23H17N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.699
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 130
Number of rings: 4

     

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