COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206045
Chemical Name: (4-tert-butylphenyl){4-[4-nitro-3-(tricyclo[3.3.1.1~3,7~]dec-2-ylamino)phenyl]piperazin-1-yl}methanone
Smiles: [O-][N+](=O)c1ccc(cc1NC1C2CC3CC1CC(C2)C3)N1CCN(CC1)C(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 516.68
Empirical Formula: C31H40N4O3

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 7.509
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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