COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK967855
Chemical Name: 2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-1-(4-bromophenyl)propan-1-one
Smiles: CCNc1nc(NCC)nc2n1c(nn2)SC(C(=O)c1ccc(cc1)Br)C

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Molecular Weight: 450.36
Empirical Formula: C17H20BrN7OS

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 3.47
Rotatable bonds: 5
H-donors: 2
H-acceptors: 1
PSA: 122
Number of rings: 3

     

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