COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570151
Chemical Name: methyl(1-{3-[(Z)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}-3-oxopiperazin-2-yl)acetate
Smiles: CCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCNC(=O)C2CC(=O)OC)/C1=O

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Molecular Weight: 557.69
Empirical Formula: C26H31N5O5S2

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 1.75
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 169
Number of rings: 4

     

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