COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK569912
Chemical Name: 3-{[3-(1H-benzotriazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}phenyl2-nitrobenzoate
Smiles: O=C1c2ccccc2C(=O)C(=C1Nc1cccc(c1)OC(=O)c1ccccc1[N+](=O)[O-])n1nnc2c1cccc2

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Molecular Weight: 531.48
Empirical Formula: C29H17N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.716
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 6

     

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