COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120671
Chemical Name: N-[4-(4-benzyl-5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]-3-methylbenzamide
Smiles: Fc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccccc1)c1ccc(cc1)NC(=O)c1cccc(c1)C

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Molecular Weight: 536.63
Empirical Formula: C31H25FN4O2S

Physical State: Dry powder
Available Amount: 425 mg

Lipinsky:
logP: 7.469
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 5

     

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