COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK686803
Chemical Name: 2-[2-amino-3-cyano-5-oxo-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1

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Molecular Weight: 543.65
Empirical Formula: C29H29N5O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.599
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 153
Number of rings: 7

     

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