COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048141
Chemical Name: 2-{5-[(E)-(1-cyclopropyl-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-2,4-dimethoxybenzyl}-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(OC)c(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C/1\C(=O)N=C(N(C1=O)C1CC1)S

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Molecular Weight: 491.52
Empirical Formula: C25H21N3O6S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.261
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 144
Number of rings: 5

     

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