COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362078
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-{3,5-dichloro-4-[(2-chlorobenzyl)oxy]phenyl}prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(Cl)c(c(c1)Cl)OCc1ccccc1Cl)/c1nc2c(s1)cccc2

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Molecular Weight: 471.79
Empirical Formula: C23H13Cl3N2OS

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 8.108
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 74
Number of rings: 4

     

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