COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210653
Chemical Name: 2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5-(furan-2-yl)cyclohexane-1,3-dione
Smiles: Clc1ccc(cc1)c1c(N/C=C/2\C(=O)CC(CC2=O)c2ccco2)[nH]nc1C

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Molecular Weight: 395.85
Empirical Formula: C21H18ClN3O3

Physical State: Dry powder
Available Amount: 377 mg

Lipinsky:
logP: 3.261
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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