COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262006
Chemical Name: methyl[(4Z)-4-(1-{[2-(4-chlorophenyl)ethyl]amino}ethylidene)-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl]acetate
Smiles: COC(=O)CC1=NN(C(=O)/C/1=C(\NCCc1ccc(cc1)Cl)/C)c1ccccc1

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Molecular Weight: 411.89
Empirical Formula: C22H22ClN3O3

Physical State: Dry powder
Available Amount: 424 mg

Lipinsky:
logP: 4.775
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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