COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678646
Chemical Name: 3-methyl-7-(3-{[(2E)-1-methylazepan-2-ylidene]amino}propyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCCCC/C/1=N\CCCn1cnc2c1c(=O)[nH]c(=O)n2C

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Saltdata: HCl
Molecular Weight: 332.41
Empirical Formula: C16H24N6O2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 1.474
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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