COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK680661
Chemical Name: 5-{(1E)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cc(ccc1OC)/C=C(/C(=O)Nc1ccc(cc1)F)\C#N

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Molecular Weight: 446.43
Empirical Formula: C25H19FN2O5

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 5.327
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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