COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148941
Chemical Name: 5-[4-(ethylsulfonyl)piperazin-1-yl]-2-nitro-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]aniline
Smiles: CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)[N+](=O)[O-]

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Molecular Weight: 476.64
Empirical Formula: C24H36N4O4S

Physical State: Dry powder
Available Amount: 356 mg

Lipinsky:
logP: 6.61
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 6

     

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