COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK811356
Chemical Name: propan-2-yl6-methyl-4-{3-[3-methyl-4-(prop-2-en-1-yloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: C=CCOc1ccc(cc1C)c1nn(cc1C1NC(=O)NC(=C1C(=O)OC(C)C)C)c1ccccc1

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Saltdata: 1/2CH3COOH
Molecular Weight: 486.57
Empirical Formula: C28H30N4O4

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.794
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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