COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889270
Chemical Name: [(7E)-7-(3,4-dimethoxybenzylidene)-3-(3,4-dimethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-nitrophenyl)methanone
Smiles: COc1cc(ccc1OC)C1C2CCC/C(=C\c3ccc(c(c3)OC)OC)/C2=NN1C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 557.6
Empirical Formula: C31H31N3O7

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.983
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 115
Number of rings: 5

     

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