COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815698
Chemical Name: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-9-methyl-3-[(Z)-(3-octyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cccc3C)N2CCN(CC2)CCO)/C1=O

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Molecular Weight: 543.75
Empirical Formula: C27H37N5O3S2

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 3.757
Rotatable bonds: 10
H-donors: 1
H-acceptors: 3
PSA: 137
Number of rings: 4

     

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