COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186588
Chemical Name: (2E,5E)-2-[(5-chloro-2-methylphenyl)imino]-5-[5-nitro-2-(pyrimidin-2-ylsulfanyl)benzylidene]-1,3-thiazolidin-4-one
Smiles: Clc1ccc(c(c1)/N=C/1\NC(=O)/C(=C\c2cc(ccc2Sc2ncccn2)[N+](=O)[O-])/S1)C

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Molecular Weight: 483.96
Empirical Formula: C21H14ClN5O3S2

Available Amount: 0 mg

Lipinsky:
logP: 4.097
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 163
Number of rings: 4

     

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