COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL127277
Chemical Name: 3-(1,3-benzodioxol-5-yl)-7-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Smiles: COc1ccc(cc1)N1CCN(CC1)c1ncc2c(n1)[nH]c(=O)n(c2=O)c1ccc2c(c1)OCO2

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Molecular Weight: 474.48
Empirical Formula: C24H22N6O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.307
Rotatable bonds: 0
H-donors: 1
H-acceptors: 5
PSA: 109
Number of rings: 6

     

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