COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL125894
Chemical Name: 1-(4-{[(9-chloro-6-methyl-5,5-dioxido-6H-pyrimido[5,4-c][2,1]benzothiazin-2-yl)sulfanyl]methyl}phenyl)pyrrolidin-2-one
Smiles: Clc1ccc2c(c1)c1nc(SCc3ccc(cc3)N3CCCC3=O)ncc1S(=O)(=O)N2C

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Molecular Weight: 487
Empirical Formula: C22H19ClN4O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.325
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 117
Number of rings: 5

     

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