COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK148611
Chemical Name: 2-{4-[4-nitro-3-({1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}amino)phenyl]piperazin-1-yl}ethanol
Smiles: OCCN1CCN(CC1)c1ccc(c(c1)NC(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)C)[N+](=O)[O-]

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Molecular Weight: 428.58
Empirical Formula: C24H36N4O3

Physical State: Dry powder
Available Amount: 631 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 84
Number of rings: 6

     

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