COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472616
Chemical Name: methyl2-({(2E)-2-cyano-3-[1-(4-fluorobenzyl)-1H-indol-3-yl]prop-2-enoyl}amino)-5-phenylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1)F)/C(=O)Nc1sc(cc1C(=O)OC)c1ccccc1

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Molecular Weight: 535.6
Empirical Formula: C31H22FN3O3S

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 8.759
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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