COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK689127
Chemical Name: 2-[2-amino-4-(1,3-benzodioxol-5-yl)-3-cyano-5-oxo-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(C1c1ccc3c(c1)OCO3)C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1

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Molecular Weight: 497.58
Empirical Formula: C27H23N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.022
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 143
Number of rings: 8

     

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