COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993741
Chemical Name: 4-[(7E)-7-(2-chlorobenzylidene)-3-(2-chlorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C2C(C1c1ccccc1Cl)CCC/C/2=C\c1ccccc1Cl

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Molecular Weight: 457.36
Empirical Formula: C24H22Cl2N2O3

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 4.485
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 69
Number of rings: 4

     

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