COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK968574
Chemical Name: 2-bromo-N-[(1Z)-3-oxo-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-1-(thiophen-2-yl)prop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C/c1cccs1)/NC(=O)c1ccccc1Br)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 524.44
Empirical Formula: C25H22BrN3O3S

Available Amount: 0 mg

Lipinsky:
logP: 2.306
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 5

     

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