COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673547
Chemical Name: 7-[(Z)-[(2E)-(4-methylbenzylidene)hydrazinylidene](3-nitrophenyl)methyl]-1,3,5-triazatricyclo[3.3.1.1~3,7~]decane
Smiles: Cc1ccc(cc1)/C=N/N=C(\C12CN3CN(C2)CN(C1)C3)/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 404.47
Empirical Formula: C22H24N6O2

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 6.125
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 6

     

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