COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK788626
Chemical Name: ethyl6-amino-5-cyano-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4-(3,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc(C)cc(c2C#N)C)OC(=C(C1c1cc(OC)c(c(c1)OC)OC)C#N)N

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Molecular Weight: 536.61
Empirical Formula: C27H28N4O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.684
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 175
Number of rings: 3

     

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