COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL022807
Chemical Name: (2Z)-4-[3-(2-chlorophenyl)-5-(2-hydroxy-5-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C\C(=O)N1N=C(CC1c1cc(C)ccc1O)c1ccccc1Cl

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Molecular Weight: 384.82
Empirical Formula: C20H17ClN2O4

Available Amount: 0 mg

Lipinsky:
logP: 2.29
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 90
Number of rings: 3

     

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