COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK084663
Chemical Name: [(7E)-7-(4-methoxybenzylidene)-3-(4-methoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](2-phenylquinolin-4-yl)methanone
Smiles: COc1ccc(cc1)C1C2CCC/C(=C\c3ccc(cc3)OC)/C2=NN1C(=O)c1cc(nc2c1cccc2)c1ccccc1

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Molecular Weight: 579.7
Empirical Formula: C38H33N3O3

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 7.231
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 64
Number of rings: 7

     

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