COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149761
Chemical Name: methyl4-[({[4-(4-fluorophenyl)-5-(3,4,5-triethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCOc1cc(cc(c1OCC)OCC)c1nnc(n1c1ccc(cc1)F)SCC(=O)Nc1ccc(cc1)C(=O)OC

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Molecular Weight: 594.66
Empirical Formula: C30H31FN4O6S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 8.603
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 139
Number of rings: 4

     

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