COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561899
Chemical Name: 2-{4-[(2-ethoxy-2-oxoethyl)carbamothioyl]piperazin-1-ium-1-yl}-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: CCOC(=O)CNC(=S)N1CC[NH+](CC1)c1ncc2c(n1)n(CC)cc(c2=O)C(=O)[O-]

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Molecular Weight: 448.5
Empirical Formula: C19H24N6O5S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 0.275
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 164
Number of rings: 3

     

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