COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810788
Chemical Name: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(phenylsulfanyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(Sc3ccccc3)nc3n(c2=O)cccc3)/C1=O)C

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Molecular Weight: 453.61
Empirical Formula: C22H19N3O2S3

Physical State: Dry powder
Available Amount: 335 mg

Lipinsky:
logP: 2.178
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 135
Number of rings: 4

     

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