COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK764269
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-(4-chloro-3-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(c(c1)[N+](=O)[O-])Cl)/c1nc2c(s1)cccc2

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Molecular Weight: 341.78
Empirical Formula: C16H8ClN3O2S

Available Amount: 0 mg

Lipinsky:
logP: 5.007
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 3

     

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