COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181350
Chemical Name: (2E)-2-cyano-N-(4-methoxyphenyl)-3-(1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(c2c1cccc2)CCOc1cc(C)ccc1C(C)C)/C(=O)Nc1ccc(cc1)OC

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Molecular Weight: 493.61
Empirical Formula: C31H31N3O3

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 7.274
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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