COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527083
Chemical Name: N-[(E)-(5-nitrothiophen-2-yl)methylidene]-1,3,5-triazatricyclo[3.3.1.1~3,7~]decan-7-amine
Smiles: [O-][N+](=O)c1ccc(s1)/C=N/C12CN3CN(C2)CN(C1)C3

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Molecular Weight: 293.35
Empirical Formula: C12H15N5O2S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.04
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 96
Number of rings: 5

     

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