COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922051
Chemical Name: 1-(4-bromophenyl)-2-[(5-{(2Z)-2-[1-(3,4-dimethoxyphenyl)ethylidene]hydrazinyl}-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: COc1cc(ccc1OC)/C(=N\Nc1nnc([nH]1)SCC(=O)c1ccc(cc1)Br)/C

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Molecular Weight: 490.38
Empirical Formula: C20H20BrN5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.815
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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