COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114719
Chemical Name: methyl4-{[({5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)C(Oc1ccc(cc1)CC)C

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Molecular Weight: 454.55
Empirical Formula: C23H26N4O4S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.344
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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