COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811379
Chemical Name: 3-{(Z)-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[(tetrahydrofuran-2-ylmethyl)amino]-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: S=C1S/C(=C\c2c(NCC3CCCO3)nc3n(c2=O)cccc3)/C(=O)N1C1CCS(=O)(=O)C1

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Molecular Weight: 506.63
Empirical Formula: C21H22N4O5S3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: -1.953
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 174
Number of rings: 5

     

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