COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK422780
Chemical Name: methyl(2E)-3-(3-butoxyphenyl)-2-cyanoprop-2-enoate
Smiles: CCCCOc1cccc(c1)/C=C(/C(=O)OC)\C#N

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Molecular Weight: 259.3
Empirical Formula: C15H17NO3

Physical State: Dry powder
Available Amount: 375 mg

Lipinsky:
logP: 3.398
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 1

     

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