COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL438671
Chemical Name: 2-(1-{4-[2-({[4-(4-chlorophenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]piperazin-1-yl}ethylidene)-1H-indene-1,3(2H)-dione
Smiles: C/C(=C/1\C(=O)c2c(C1=O)cccc2)/N1CCN(CC1)CCN/C=C/1\C(=O)CC(CC1=O)c1ccc(cc1)Cl

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Molecular Weight: 532.04
Empirical Formula: C30H30ClN3O4

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 4.121
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 86
Number of rings: 5

     

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