COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL364949
Chemical Name: 2-[(4-ethyl-5-phenyl-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)c1ccccc1

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Molecular Weight: 398.53
Empirical Formula: C21H26N4O2S

Physical State: Dry powder
Available Amount: 683 mg

Lipinsky:
logP: 4.642
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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