COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316597
Chemical Name: furan-2-yl(4-{[3-(3-nitro-1H-1,2,4-triazol-1-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]carbonyl}piperazin-1-yl)methanone
Smiles: O=C(C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccco1

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Molecular Weight: 454.49
Empirical Formula: C22H26N6O5

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 0.824
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 130
Number of rings: 7

     

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