COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705189
Chemical Name: 2-(ethylamino)-3-[(Z)-(3-heptyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCCCCN1C(=S)S/C(=C\c2c(NCC)nc3n(c2=O)cccc3C)/C1=O

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Molecular Weight: 444.62
Empirical Formula: C22H28N4O2S2

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 3.294
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 122
Number of rings: 3

     

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