COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444011
Chemical Name: 2-({5-[(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[3-(morpholin-4-yl)propyl]acetamide
Smiles: O=C(CSc1nnc(n1c1ccccc1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)NCCCN1CCOCC1

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Molecular Weight: 570.67
Empirical Formula: C30H30N6O4S

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 2.823
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 134
Number of rings: 6

     

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