COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK171865
Chemical Name: (3-fluorophenyl){4-[4-nitro-3-(tricyclo[3.3.1.1~3,7~]dec-2-ylamino)phenyl]piperazin-1-yl}methanone
Smiles: Fc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NC1C2CC3CC1CC(C2)C3)[N+](=O)[O-]

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Molecular Weight: 478.57
Empirical Formula: C27H31FN4O3

Physical State: Dry powder
Available Amount: 134 mg

Lipinsky:
logP: 6.074
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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