COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK903880
Chemical Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-7-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(CN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccc(cc2)F)/C1=O)C

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Saltdata: 1/3CH3COOH
Molecular Weight: 537.68
Empirical Formula: C27H28FN5O2S2

Physical State: Dry powder
Available Amount: 398 mg

Lipinsky:
logP: 2.989
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 5

     

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