COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL175907
Chemical Name: diethyl1-{2-[3-(2,5-dimethylphenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Smiles: CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)N1N=C(CC1c1ccc(cc1)OC)c1cc(C)ccc1C

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Molecular Weight: 533.58
Empirical Formula: C28H31N5O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.567
Rotatable bonds: 9
H-donors: 0
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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