COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152627
Chemical Name: ethyl[(2Z)-2-({[1-(3,5-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]carbonyl}imino)-2,3-dihydro-1,3-thiazol-4-yl]acetate
Smiles: CCOC(=O)Cc1cs/c(=N\C(=O)c2cnn(c2n2cccc2)c2cc(F)cc(c2)F)/[nH]1

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Molecular Weight: 457.46
Empirical Formula: C21H17F2N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.628
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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