COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL134873
Chemical Name: (2E)-2-cyano-3-[(2,5-dimethoxyphenyl)amino]-3-(methylsulfanyl)prop-2-enamide
Smiles: CS/C(=C(/C(=O)N)\C#N)/Nc1cc(OC)ccc1OC

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Molecular Weight: 293.35
Empirical Formula: C13H15N3O3S

Physical State: Dry powder
Available Amount: 772 mg

Lipinsky:
logP: -0.136
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 122
Number of rings: 1

     

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