COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK117430
Chemical Name: 1-{4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl}-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethanone
Smiles: CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)CC12CC3CC(C2)CC(C1)C3

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Molecular Weight: 412.53
Empirical Formula: C23H32N4O3

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.631
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 6

     

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