COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK212314
Chemical Name: 1-(4-{4-[3-acetyl-1-(3,4-dichlorophenyl)-5-(4-ethoxyphenyl)-1,5-dihydro-4H-1,2,4-triazol-4-yl]phenyl}piperazin-1-yl)ethanone
Smiles: CCOc1ccc(cc1)C1N(N=C(N1c1ccc(cc1)N1CCN(CC1)C(=O)C)C(=O)C)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 580.51
Empirical Formula: C30H31Cl2N5O3

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 3.879
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 68
Number of rings: 5

     

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