COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173863
Chemical Name: 5-{3-[(4-bromophenoxy)methyl]phenyl}-4-[3-(diethylamino)propyl]-4H-1,2,4-triazole-3-thiol
Smiles: CCN(CCCn1c(S)nnc1c1cccc(c1)COc1ccc(cc1)Br)CC

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Molecular Weight: 475.45
Empirical Formula: C22H27BrN4OS

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 6.777
Rotatable bonds: 9
H-donors: 0
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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