COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL200416
Chemical Name: ethyl(2E)-3-[5-(5-chloro-2-hydroxyphenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]but-2-enoate
Smiles: CCOC(=O)/C=C(/N1N=C(CC1c1cc(Cl)ccc1O)c1ccc(cc1)F)\C

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Molecular Weight: 402.85
Empirical Formula: C21H20ClFN2O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.517
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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