COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK556827
Chemical Name: N~2~-benzyl-N~4~-(3,4-dimethylphenyl)-N~2~-methyl-5-nitropyrimidine-2,4,6-triamine
Smiles: CN(c1nc(Nc2ccc(c(c2)C)C)c(c(n1)N)[N+](=O)[O-])Cc1ccccc1

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Molecular Weight: 378.43
Empirical Formula: C20H22N6O2

Physical State: Dry powder
Available Amount: 452 mg

Lipinsky:
logP: 8.433
Rotatable bonds: 1
H-donors: 3
H-acceptors: 2
PSA: 112
Number of rings: 3

     

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