COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383501
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-[3-chloro-5-ethoxy-4-(naphthalen-1-ylmethoxy)phenyl]prop-2-enenitrile
Smiles: CCOc1cc(cc(c1OCc1cccc2c1cccc2)Cl)/C=C(/c1nc2c(s1)cccc2)\C#N

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Molecular Weight: 497.02
Empirical Formula: C29H21ClN2O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 8.821
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 5

     

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