COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049312
Chemical Name: N'-{(E)-[4-(benzyloxy)phenyl]methylidene}-2-{[5-(4-bromophenyl)-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: CC(=C)Cn1c(SCC(=O)N/N=C/c2ccc(cc2)OCc2ccccc2)nnc1c1ccc(cc1)Br

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Molecular Weight: 576.52
Empirical Formula: C28H26BrN5O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.867
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 106
Number of rings: 4

     

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