COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889116
Chemical Name: 4-[(7E)-7-(3,4-dimethoxybenzylidene)-3-(3,4-dimethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-4-oxobutanoicacid
Smiles: COc1ccc(cc1OC)/C=C/1\CCCC2C1=NN(C2c1ccc(c(c1)OC)OC)C(=O)CCC(=O)O

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Molecular Weight: 508.57
Empirical Formula: C28H32N2O7

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 3.075
Rotatable bonds: 10
H-donors: 1
H-acceptors: 7
PSA: 106
Number of rings: 4

     

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