COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL386595
Chemical Name: ethyl3-{[(3,6-diamino-5-cyanothieno[2,3-b]pyridin-2-yl)carbonyl]amino}-3-(4-methoxyphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1sc2c(c1N)cc(c(n2)N)C#N

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 4.283
Rotatable bonds: 6
H-donors: 5
H-acceptors: 4
PSA: 181
Number of rings: 3

     

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