COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK551886
Chemical Name: methyl4-{[(1E)-3-(butylamino)-8-hydroxy-4-oxonaphthalen-1(4H)-ylidene]amino}benzoate
Smiles: CCCCNC1=C/C(=N\c2ccc(cc2)C(=O)OC)/c2c(C1=O)cccc2O

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Molecular Weight: 378.43
Empirical Formula: C22H22N2O4

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 4.564
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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