COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK906704
Chemical Name: 3-{(Z)-[3-(2-ethylhexyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(2-hydroxy-2-phenylethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CCCCC(CN1C(=S)S/C(=C\c2c(NCC(c3ccccc3)O)nc3n(c2=O)cccc3)/C1=O)CC

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Molecular Weight: 536.72
Empirical Formula: C28H32N4O3S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.308
Rotatable bonds: 10
H-donors: 2
H-acceptors: 3
PSA: 142
Number of rings: 4

     

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