COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL012346
Chemical Name: 6-amino-2-(2-hydroxyethyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-5-sulfonicacid
Smiles: OCCn1c(=O)c2cc(c(c3c2c(c1=O)ccc3)N)S(=O)(=O)O

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Molecular Weight: 336.33
Empirical Formula: C14H12N2O6S

Physical State: Dry powder
Available Amount: 1938 mg

Lipinsky:
logP: -1.573
Rotatable bonds: 5
H-donors: 4
H-acceptors: 6
PSA: 146
Number of rings: 3

     

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