COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889218
Chemical Name: [(7E)-7-(4-chlorobenzylidene)-3-(4-chlorophenyl)-5-methyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](3,4,5-trimethoxyphenyl)methanone
Smiles: COc1cc(cc(c1OC)OC)C(=O)N1N=C2C(C1c1ccc(cc1)Cl)CC(C/C/2=C\c1ccc(cc1)Cl)C

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Molecular Weight: 565.5
Empirical Formula: C31H30Cl2N2O4

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 7.259
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 5

     

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