COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK810164
Chemical Name: 2-{[3-(morpholin-4-yl)propyl]amino}-3-{(Z)-[4-oxo-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: CC(N1C(=S)S/C(=C\c2c(NCCCN3CCOCC3)nc3n(c2=O)cccc3)/C1=O)C

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Saltdata: 1/3 CH3COOH
Molecular Weight: 473.62
Empirical Formula: C22H27N5O3S2

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: -0.16
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 134
Number of rings: 4

     

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