COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973027
Chemical Name: 2-{[5-(4-bromophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}hexanoicacid
Smiles: CCCCC(C(=O)O)Sc1nnc(n1c1ccccc1)c1ccc(cc1)Br

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Molecular Weight: 446.37
Empirical Formula: C20H20BrN3O2S

Available Amount: 0 mg

Lipinsky:
logP: 7.574
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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