COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038321
Chemical Name: 2-(5-{(Z)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-methoxybenzyl)-1H-isoindole-1,3(2H)-dione
Smiles: C=CCN1C(=NC(=O)/C(=C/c2ccc(c(c2)CN2C(=O)c3c(C2=O)cccc3)OC)/C1=O)S

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Molecular Weight: 461.5
Empirical Formula: C24H19N3O5S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.875
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 135
Number of rings: 4

     

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