COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150044
Chemical Name: dimethyl2-{[1-(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)ethyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1N/C(=C/1\C(=O)c2c(C1=O)cccc2)/C)C(=O)OC

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Molecular Weight: 379.37
Empirical Formula: C21H17NO6

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 5.12
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 98
Number of rings: 3

     

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