COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK185315
Chemical Name: (2E)-3-[3-chloro-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyano-N-[2-(1H-indol-3-yl)ethyl]prop-2-enamide
Smiles: C#CCOc1c(Cl)cc(cc1OCC)/C=C(/C(=O)NCCc1c[nH]c2c1cccc2)\C#N

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Molecular Weight: 447.92
Empirical Formula: C25H22ClN3O3

Physical State: Dry powder
Available Amount: 14 mg

Lipinsky:
logP: 4.273
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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