COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK697435
Chemical Name: 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]ethanone
Smiles: COCCn1c(C)cc(c1C)C(=O)CSc1nnc(n1CC)c1ccc(cc1)OC

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Molecular Weight: 428.56
Empirical Formula: C22H28N4O3S

Physical State: Dry powder
Available Amount: 1240 mg

Lipinsky:
logP: 4.808
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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