COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK043163
Chemical Name: (2E)-1-[(7E)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-3-phenylprop-2-en-1-one
Smiles: Fc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)F)C(=O)/C=C/c1ccccc1

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Molecular Weight: 454.52
Empirical Formula: C29H24F2N2O

Physical State: Dry powder
Available Amount: 390 mg

Lipinsky:
logP: 6.498
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 32
Number of rings: 5

     

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