COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631464
Chemical Name: 3,7,9-trimethyl-1-{2-[(4-phenoxyphenyl)amino]ethyl}-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(CCNc2ccc(cc2)Oc2ccccc2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

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Molecular Weight: 459.51
Empirical Formula: C24H25N7O3

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.083
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 95
Number of rings: 5

     

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