COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811685
Chemical Name: 3-[(Z)-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-2-[(4-methylbenzyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCN1C(=S)S/C(=C\c2c(NCc3ccc(cc3)C)nc3n(c2=O)cccc3C)/C1=O

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Saltdata: 1/3CH3COOH
Molecular Weight: 478.64
Empirical Formula: C25H26N4O2S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 3.554
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 122
Number of rings: 4

     

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