COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544102
Chemical Name: 2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(3-nitrophenyl)ethylidene]acetohydrazide
Smiles: COc1cc(ccc1OC)c1nnc(n1CC)SCC(=O)N/N=C(\c1cccc(c1)[N+](=O)[O-])/C

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Molecular Weight: 484.54
Empirical Formula: C22H24N6O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.697
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 161
Number of rings: 3

     

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