COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135988
Chemical Name: N-[(4-ethyl-5-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)NCc1nnc(n1CC)SCC(=O)N1CCN(CC1)C

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Molecular Weight: 432.55
Empirical Formula: C20H28N6O3S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 1.697
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 3

     

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