COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK677773
Chemical Name: 1,3-dimethyl-7-{3-[(2E)-pyrrolidin-2-ylideneamino]propyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(CCC/N=C/1\CCCN1)cn2

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Saltdata: HCl
Molecular Weight: 304.35
Empirical Formula: C14H20N6O2

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 0.787
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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