COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139871
Chemical Name: 3-methyl-N-[2-methyl-1-(4-methyl-5-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)propyl]benzamide
Smiles: CN1CCN(CC1)C(=O)CSc1nnc(n1C)C(C(C)C)NC(=O)c1cccc(c1)C

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Molecular Weight: 444.6
Empirical Formula: C22H32N6O2S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.686
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 3

     

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