COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL094482
Chemical Name: 8-bromo-2,11-dimethyl-3-(prop-2-en-1-yl)-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocine-4-thione
Smiles: C=CCN1C(=S)NC2C(C1(C)Oc1c2cc(cc1)Br)C

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Molecular Weight: 353.28
Empirical Formula: C15H17BrN2OS

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 4.126
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 56
Number of rings: 3

     

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