COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160791
Chemical Name: {1,3-dimethyl-2,6-dioxo-8-[(4-phenoxyphenyl)amino]-1,2,3,6-tetrahydro-7H-purin-7-yl}aceticacid
Smiles: OC(=O)Cn1c(Nc2ccc(cc2)Oc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 421.41
Empirical Formula: C21H19N5O5

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.545
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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