COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK191685
Chemical Name: (2E)-2-cyano-3-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Smiles: CCOc1cc(ccc1OCC#C)/C=C(/C(=O)NCCc1c[nH]c2c1cccc2)\C#N

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Molecular Weight: 413.48
Empirical Formula: C25H23N3O3

Physical State: Dry powder
Available Amount: 151 mg

Lipinsky:
logP: 3.486
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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