COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042028
Chemical Name: 3-{2-[(7Z)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-1,3-thiazol-4-yl}-2H-chromen-2-one
Smiles: Fc1ccc(cc1)C1N(N=C2C1CCC/C/2=C/c1ccc(cc1)F)c1scc(n1)c1cc2ccccc2oc1=O

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Molecular Weight: 551.62
Empirical Formula: C32H23F2N3O2S

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 6.888
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 7

     

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