COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534602
Chemical Name: (1S,8aS)-4-amino-1-(thiophen-2-yl)-6,7,8,8a-tetrahydronaphthalene-2,2,3(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C2=CCCC[C@H]2[C@@H](C1(C#N)C#N)c1cccs1

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Molecular Weight: 306.39
Empirical Formula: C17H14N4S

Physical State: Dry powder
Available Amount: 276 mg

Lipinsky:
logP: 3.152
Rotatable bonds: 1
H-donors: 2
H-acceptors: 0
PSA: 125
Number of rings: 3

     

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