COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK436281
Chemical Name: (2E)-2-cyano-N-(2,5-dichlorophenyl)-3-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(cc1)F)/C(=O)Nc1cc(Cl)ccc1Cl

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Molecular Weight: 401.23
Empirical Formula: C19H11Cl2FN4O

Physical State: Dry powder
Available Amount: 514 mg

Lipinsky:
logP: 4.669
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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