COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK510750
Chemical Name: N-{3-[3-acetyl-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}-2-methylbenzamide
Smiles: COc1cc(ccc1OC)C1N(N=C(N1c1cccc(c1)NC(=O)c1ccccc1C)C(=O)C)c1ccc(cc1)C

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Molecular Weight: 548.64
Empirical Formula: C33H32N4O4

Physical State: Dry powder
Available Amount: 220 mg

Lipinsky:
logP: 4.716
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 83
Number of rings: 5

     

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