COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK906477
Chemical Name: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-(4-fluorophenoxy)-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCC(N1C(=S)S/C(=C\c2c(Oc3ccc(cc3)F)nc3n(c2=O)cccc3)/C1=O)C

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Molecular Weight: 455.53
Empirical Formula: C22H18FN3O3S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 3.457
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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