COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK093806
Chemical Name: [(7E)-7-(4-bromobenzylidene)-3-(4-bromophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1N=C2C(C1c1ccc(cc1)Br)CCC/C/2=C\c1ccc(cc1)Br

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Molecular Weight: 580.32
Empirical Formula: C28H24Br2N2O2

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 7.286
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 5

     

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