COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561852
Chemical Name: 8-ethyl-5-oxo-2-{4-[(1-phenylethyl)carbamothioyl]piperazin-1-ium-1-yl}-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
Smiles: CCn1cc(C(=O)[O-])c(=O)c2c1nc(nc2)[NH+]1CCN(CC1)C(=S)NC(c1ccccc1)C

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Molecular Weight: 466.56
Empirical Formula: C23H26N6O3S

Physical State: Dry powder
Available Amount: 367 mg

Lipinsky:
logP: 1.924
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 138
Number of rings: 4

     

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