COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028840
Chemical Name: (4-methylphenyl)[4-(4-nitro-3-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}phenyl)piperazin-1-yl]methanone
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)NC(C12CC3CC(C2)CC(C1)C3)C)[N+](=O)[O-]

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Molecular Weight: 502.66
Empirical Formula: C30H38N4O3

Physical State: Dry powder
Available Amount: 383 mg

Lipinsky:
logP: 7.147
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 81
Number of rings: 7

     

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