COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295537
Chemical Name: 6-amino-2-(3-hydroxypropyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-5,8-disulfonicacid
Smiles: OCCCn1c(=O)c2cc(cc3c2c(c1=O)cc(c3N)S(=O)(=O)O)S(=O)(=O)O

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Molecular Weight: 430.42
Empirical Formula: C15H14N2O9S2

Physical State: Dry powder
Available Amount: 459 mg

Lipinsky:
logP: -3.104
Rotatable bonds: 8
H-donors: 5
H-acceptors: 9
PSA: 209
Number of rings: 3

     

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